data_1qwv_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 1qwv _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.557 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.9 Cg_endo . . . . . 0 C--O 1.232 0.221 0 N-CA-C 112.855 0.29 . . . . 0.0 112.855 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.01 -69.07 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.568 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 4' ' ' ILE . 6.6 tp -80.61 -9.71 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 121.132 0.491 . . . . 0.0 111.638 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.557 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 78.4 mtp -73.98 -21.18 60.09 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.47 176.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -74.1 91.68 2.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -73.04 131.84 42.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.52 -174.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 71.6 mt -55.99 -47.49 77.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.124 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.609 ' HB3' HD21 ' A' ' 55' ' ' LEU . 49.2 m -61.89 -29.97 70.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.438 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -75.27 -36.04 61.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.422 . . . . 0.0 110.295 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -68.71 -52.65 28.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.985 178.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -51.41 -78.01 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 173.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . 0.411 ' HA2' ' HE3' ' A' ' 16' ' ' MET . . . 55.5 35.49 61.74 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.631 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -75.65 -41.17 54.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.071 0.436 . . . . 0.0 111.42 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.91 99.36 3.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.861 0.362 . . . . 0.0 111.227 -173.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.411 ' HE3' ' HA2' ' A' ' 13' ' ' GLY . 0.0 OUTLIER -81.33 -46.68 14.35 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.255 -178.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.07 -30.74 71.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.948 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -87.82 -21.99 24.74 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.727 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.2 t -75.21 -34.97 61.53 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 167.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.794 ' HA ' HD12 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -61.16 -45.58 94.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.897 178.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -71.16 -40.37 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.788 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.645 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 30.6 tp10 -60.09 -44.07 95.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.373 -0.131 . . . . 0.0 111.042 -173.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.716 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.4 mt -88.44 -8.58 54.7 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.496 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.5 m 57.68 37.57 27.36 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.133 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.794 HD12 ' HA ' ' A' ' 20' ' ' LYS . 5.0 mp -54.08 121.53 30.62 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.293 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.96 155.4 68.24 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.191 1.927 . . . . 0.0 110.878 172.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.68 -31.98 71.21 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.7 p -63.8 -40.4 96.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.707 0.289 . . . . 0.0 111.444 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.5 t -76.21 -55.73 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.643 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -59.61 -28.79 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.935 0.398 . . . . 0.0 110.865 -176.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.56 -51.43 35.49 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.29 -35.98 82.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.318 0.58 . . . . 0.0 110.031 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -38.62 69.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.395 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -78.54 8.9 4.53 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.474 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 43.7 t30 -65.65 107.74 1.84 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.709 0.686 . . . . 0.0 109.747 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -81.16 -18.38 46.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.227 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.474 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 30.4 m-90 -73.45 131.71 42.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -80.71 53.29 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.125 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.558 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 37.7 t70 -43.73 -42.67 5.55 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 172.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.4 t70 66.36 61.31 0.59 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-O 121.716 0.769 . . . . 0.0 109.929 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.558 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -97.28 177.32 5.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.107 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.2 t -84.29 126.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.74 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 37.5 ttm -67.11 103.46 1.2 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.0 p -101.72 -26.74 13.39 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -173.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.601 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 15.3 t70 -101.62 122.51 44.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.69 0.757 . . . . 0.0 112.493 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.988 ' HB2' ' HB3' ' A' ' 108' ' ' CYS . 0.1 OUTLIER -47.59 -40.94 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.132 172.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.811 HD22 ' HG2' ' A' ' 46' ' ' ARG . 2.9 mm? -65.87 -19.24 65.81 Favored 'General case' 0 C--N 1.333 -0.144 0 O-C-N 122.021 -0.425 . . . . 0.0 111.068 -176.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.08 -61.24 1.96 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.12 -48.13 2.65 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 114.688 -1.142 . . . . 0.0 114.504 168.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.5 m -67.31 -41.95 84.51 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.405 1.102 . . . . 0.0 111.674 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.478 ' HB1' HD21 ' A' ' 25' ' ' LEU . . . -63.24 -23.86 67.61 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.9 mt -58.09 -39.23 71.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.992 0.425 . . . . 0.0 110.946 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.499 ' O ' ' HB ' ' A' ' 57' ' ' THR . 3.7 p-10 -113.84 42.84 1.93 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.481 0.658 . . . . 0.0 110.16 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 10.6 t -98.75 -46.4 5.69 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.656 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 9' ' ' SER . 4.4 mm? -60.31 -55.88 28.24 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 111.963 -174.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.09 -16.62 49.41 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.909 -172.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 53' ' ' ASN . 18.1 m -84.93 -42.37 15.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.372 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.645 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 5.8 mmmt -72.76 -15.97 61.65 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.373 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.84 -65.92 0.61 Allowed 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 172.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -176.28 119.14 0.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.056 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.481 ' CG1' HG21 ' A' ' 57' ' ' THR . 9.2 p -175.62 31.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 121.54 0.686 . . . . 0.0 111.327 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.522 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 32.9 m -93.34 118.72 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 O-C-N 121.147 -0.971 . . . . 0.0 111.401 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.31 -53.27 10.67 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.505 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.684 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -98.99 -143.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 123.345 2.696 . . . . 0.0 112.999 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 6.3 p-10 -72.21 -5.72 37.8 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.633 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 151.41 -60.96 0.41 Allowed Glycine 0 C--N 1.316 -0.572 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.684 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -85.36 165.48 17.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.815 -0.692 . . . . 0.0 109.817 176.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.09 29.79 4.62 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.308 0.575 . . . . 0.0 111.308 171.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.552 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 9.2 p80 -73.4 74.3 1.38 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.192 0.52 . . . . 0.0 111.794 177.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -86.38 -50.86 6.6 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.13 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.4 -61.71 6.58 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.948 -172.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -56.68 -31.08 64.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.67 -37.95 76.89 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.219 0.533 . . . . 0.0 110.968 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -79.73 -35.59 38.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.0 -40.96 95.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.457 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -63.57 -38.78 92.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.663 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.09 78.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.066 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.514 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 72.0 mtm -73.63 -23.46 59.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.812 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -93.22 -14.26 27.31 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.935 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -144.99 95.41 2.68 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 120.742 0.306 . . . . 0.0 111.042 -177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.38 -70.11 0.42 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.236 173.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -103.72 135.4 45.34 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.437 ' OD1' HG21 ' A' ' 85' ' ' THR . 1.0 OUTLIER -80.21 172.56 13.61 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.197 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -23.25 67.16 Favored 'General case' 0 N--CA 1.422 -1.872 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.604 -167.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.807 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 1.2 t -73.19 -30.9 63.86 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.481 -177.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.473 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 71.9 mtp -81.93 -41.2 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.376 0.608 . . . . 0.0 109.362 -175.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -62.29 -33.23 74.25 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.235 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.74 -21.45 51.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.25 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' A' ' 85' ' ' THR . 10.6 mm-40 -77.74 -25.31 49.14 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 172.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.512 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.2 mp -85.45 -42.94 14.03 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.604 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 87' ' ' ALA . 29.8 m -56.91 -32.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.86 0.362 . . . . 0.0 111.809 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.17 -44.91 78.52 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.601 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.582 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.5 mp -67.62 -43.75 86.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 90' ' ' LEU . 50.0 mt -52.67 -48.7 48.16 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.786 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -71.7 -36.54 70.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.196 -174.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.33 -44.4 6.6 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 119.722 -1.228 . . . . 0.0 112.367 -172.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.742 ' HB2' HG12 ' A' ' 114' ' ' VAL . 38.7 m -72.23 -41.11 67.2 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.854 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -63.89 -38.79 92.4 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 117.948 0.34 . . . . 0.0 110.798 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -67.14 -34.46 77.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 m -95.79 5.34 51.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.259 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.33 149.44 78.91 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.719 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.468 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 22.7 Cg_exo -65.37 144.53 80.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.731 2.287 . . . . 0.0 111.195 178.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 7.9 Cg_exo -73.37 35.52 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.425 2.75 . . . . 0.0 113.314 -175.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -76.77 112.08 12.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -77.75 96.22 4.85 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -167.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.0 t0 -144.04 100.73 3.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 163.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -40.77 -44.75 2.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.988 ' HB3' ' HB2' ' A' ' 46' ' ' ARG . 4.1 t -88.06 -24.58 23.41 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.583 1.083 . . . . 0.0 112.232 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.736 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 75.4 mmm -74.76 -26.39 59.73 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.987 -0.445 . . . . 0.0 111.884 -175.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.555 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -60.14 -43.03 96.04 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.766 0.793 . . . . 0.0 110.032 178.192 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.555 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.03 -14.9 7.46 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.35 174.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.554 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.5 mp -89.95 -38.0 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.658 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 14.4 t70 -60.06 -34.11 72.97 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.432 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.742 HG12 ' HB2' ' A' ' 97' ' ' CYS . 14.0 m -80.57 -39.47 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.574 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.75 -49.64 76.68 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.323 0.582 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.711 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.84 -24.67 63.49 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.305 178.918 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.4 t -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.171 0.51 . . . . 0.0 110.137 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.58 ' HB2' HG22 ' A' ' 93' ' ' ILE . 73.7 t80 -79.65 -45.87 18.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.123 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -69.27 -28.8 66.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.71 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.711 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.54 -51.06 71.48 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.916 0.389 . . . . 0.0 110.452 170.349 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -57.52 -54.9 41.64 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.67 177.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.461 HD11 HG21 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -58.14 -32.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 120.699 0.285 . . . . 0.0 111.44 178.79 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -71.22 -30.63 66.59 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.615 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.28 -33.07 67.17 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.56 172.471 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.581 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 18.5 Cg_endo . . . . . 0 N--CA 1.475 0.404 0 N-CA-C 114.384 0.878 . . . . 0.0 114.384 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.5 -69.13 0.12 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.72 0.295 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.71 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.2 mm -80.16 -15.08 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-O 121.092 0.472 . . . . 0.0 111.676 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.581 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 13.4 tmm? -64.64 -38.2 90.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.016 0.436 . . . . 0.0 110.267 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -93.45 120.38 33.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.36 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -71.79 133.83 45.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.789 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 80' ' ' HIS . 50.7 mt -57.7 -43.15 84.97 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.035 0.209 . . . . 0.0 110.914 178.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.0 m -61.79 -38.72 89.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.897 0.379 . . . . 0.0 110.763 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -75.47 -34.56 60.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.4 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -67.19 -54.05 24.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.678 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HD2' ' O ' ' A' ' 8' ' ' LEU . 32.9 m-85 -47.45 -73.02 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.459 168.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.01 40.23 58.18 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.306 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' LYS . 12.2 tmtt? -67.48 -58.14 5.27 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.1 90.46 1.36 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.684 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 64.6 mtt -71.62 -27.19 62.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.251 0.548 . . . . 0.0 109.773 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 37.3 t70 -62.27 -24.69 67.42 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.799 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -88.13 -25.14 23.14 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.197 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.6 t -76.13 -36.58 58.74 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.76 -42.09 97.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.462 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -71.3 -42.85 68.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.088 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.535 ' CD ' ' HZ1' ' A' ' 58' ' ' LYS . 18.9 tt0 -70.24 -41.46 73.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.352 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.805 ' HB2' HD13 ' A' ' 25' ' ' LEU . 15.3 mt -83.48 1.17 43.1 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.972 0.415 . . . . 0.0 111.291 -177.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.8 m 67.38 31.92 6.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.721 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.805 HD13 ' HB2' ' A' ' 23' ' ' LEU . 8.4 mp -62.15 121.4 65.78 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.724 175.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -71.07 160.22 49.91 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.89 2.393 . . . . 0.0 111.167 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.758 ' HA ' HG23 ' A' ' 30' ' ' VAL . 4.6 p-10 -69.4 -16.42 63.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.34 -176.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 p -64.85 -48.83 72.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 0.0 110.341 174.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.2 t -71.0 -45.82 70.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.256 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.758 HG23 ' HA ' ' A' ' 27' ' ' ASP . 14.9 m -59.28 -30.04 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.975 0.417 . . . . 0.0 110.043 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.54 -52.19 54.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.798 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.02 -36.11 81.38 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.104 0.478 . . . . 0.0 110.202 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -54.99 25.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.177 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -66.95 11.08 0.11 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -64.36 118.27 8.46 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.02 1.282 . . . . 0.0 110.063 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -92.55 -36.33 13.09 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -77.39 151.18 34.94 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.217 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -80.13 60.24 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.951 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -55.49 -36.33 66.52 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.713 171.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.1 t0 59.41 70.92 0.61 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.51 0.671 . . . . 0.0 110.087 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.418 ' O ' ' HD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.22 164.66 11.57 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.68 -179.283 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.2 t -85.44 115.16 26.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 173.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.625 ' O ' HG23 ' A' ' 112' ' ' ILE . 39.4 ttp -72.49 99.08 2.41 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.028 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.8 p -110.48 -9.99 14.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.839 -175.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -80.41 134.22 35.98 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.851 0.834 . . . . 0.0 110.443 178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.723 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 6.2 mpt_? -72.99 -29.12 62.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.227 -1.352 . . . . 0.0 110.681 -170.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.677 ' HB3' ' HG ' ' A' ' 25' ' ' LEU . 3.3 mm? -76.13 -15.25 60.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.495 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.57 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -84.46 -58.73 2.62 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.8 -47.53 1.8 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.187 -0.915 . . . . 0.0 114.096 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.403 ' HB3' HD13 ' A' ' 23' ' ' LEU . 7.3 m -66.55 -43.93 83.72 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.292 1.046 . . . . 0.0 111.641 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.663 ' HB1' HD21 ' A' ' 25' ' ' LEU . . . -67.82 -23.97 65.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.87 0.367 . . . . 0.0 111.861 -177.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 48' ' ' ALA . 37.2 mm -65.6 -32.41 58.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.981 0.42 . . . . 0.0 110.835 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -132.12 53.7 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.499 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.567 ' SG ' HD11 ' A' ' 55' ' ' LEU . 25.8 p -115.16 -44.05 3.04 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.59 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.567 HD11 ' SG ' ' A' ' 54' ' ' CYS . 9.0 mp -54.52 -44.0 72.4 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.197 0.523 . . . . 0.0 111.534 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.8 -11.74 59.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.318 -173.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.792 ' HA ' ' CG1' ' A' ' 61' ' ' VAL . 13.2 m -83.63 -33.17 25.35 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.646 0.736 . . . . 0.0 110.211 174.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.535 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 13.3 mmmt -71.26 -31.48 67.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.249 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.95 -67.07 0.47 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.72 172.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -178.97 123.21 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.546 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.792 ' CG1' ' HA ' ' A' ' 57' ' ' THR . 7.9 p -177.42 32.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.431 0.634 . . . . 0.0 112.171 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.534 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.1 m -101.34 123.22 54.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.691 -1.256 . . . . 0.0 111.42 -177.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.437 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 12.3 t70 -73.5 -54.29 4.09 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.891 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.732 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 57.0 Cg_endo -104.62 -139.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 123.398 2.732 . . . . 0.0 113.066 -171.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.408 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 18.3 m-20 -73.25 3.0 6.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.673 -175.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.41 -75.47 0.33 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.785 -0.722 . . . . 0.0 111.35 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.667 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.2 p-10 -76.53 157.05 32.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.183 -0.508 . . . . 0.0 110.742 177.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.648 HD23 HD21 ' A' ' 67' ' ' ASN . 4.3 mm? 69.49 34.17 2.89 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.585 0.553 . . . . 0.0 111.22 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.732 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.7 p80 -73.71 79.98 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.439 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -87.69 -57.25 3.01 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.424 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.12 -63.08 5.03 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.086 -169.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -59.36 -22.86 61.96 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.431 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -72.7 -33.83 66.74 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.965 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 29.8 mmmt -78.82 -31.62 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.059 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -64.96 -39.97 94.29 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -61.64 -36.89 82.08 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.704 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.17 -40.85 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.828 0.346 . . . . 0.0 110.991 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.56 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 73.9 mtm -75.18 -19.76 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.199 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -90.13 -16.26 29.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.231 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.556 ' O ' HD12 ' A' ' 8' ' ' LEU . 52.9 m-70 -143.27 96.34 2.9 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.653 0.263 . . . . 0.0 110.37 -175.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.85 -62.64 0.3 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.125 172.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.71 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.43 139.74 38.93 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.046 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.508 ' OD2' HG21 ' A' ' 85' ' ' THR . 0.7 OUTLIER -82.25 169.02 17.03 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 168.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 12.2 pt-20 -68.09 -22.65 64.9 Favored 'General case' 0 N--CA 1.409 -2.487 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.298 -165.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.508 HG21 ' OD2' ' A' ' 83' ' ' ASP . 1.4 t -73.22 -29.43 62.79 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.08 -175.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 61.1 mtm -87.22 -38.82 16.01 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.601 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -60.21 -37.64 80.93 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.321 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.8 mp0 -77.2 -21.85 53.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.275 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 85' ' ' THR . 3.5 mm-40 -77.23 -22.12 52.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.027 171.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 94' ' ' ILE . 28.8 tp -88.26 -39.38 14.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.65 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.601 HG12 ' O ' ' A' ' 87' ' ' ALA . 18.2 m -57.59 -35.92 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -171.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.71 -38.13 83.18 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.036 -175.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.872 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.5 mp -65.79 -39.59 85.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 171.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.6 mt -58.04 -48.19 84.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.988 -178.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -70.93 -36.4 72.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.517 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.12 -46.09 6.02 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.17 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.525 ' SG ' HG23 ' A' ' 93' ' ' ILE . 48.7 m -72.73 -38.27 67.49 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 116.494 0.147 . . . . 0.0 110.919 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.55 -39.3 76.35 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.295 -0.253 . . . . 0.0 110.983 170.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -74.33 -43.01 58.48 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.144 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.1 m -94.57 14.55 20.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.708 -173.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.21 151.39 81.71 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.509 ' C ' ' H ' ' A' ' 104' ' ' ASN . 51.5 Cg_exo -56.63 163.26 7.23 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.924 2.416 . . . . 0.0 112.189 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.92 33.34 0.13 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.482 2.788 . . . . 0.0 113.168 177.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.509 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.4 m-20 -121.81 101.9 7.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -79.56 96.12 6.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.99 0.9 . . . . 0.0 109.546 178.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -90.42 104.73 17.27 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.619 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -31.29 -77.26 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 O-C-N 124.824 1.328 . . . . 0.0 113.735 -169.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 42.2 t -95.91 -11.08 27.21 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.826 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 1.9 tmm? -86.89 -16.34 36.3 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 112.613 -169.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.61 ' HG3' ' H ' ' A' ' 111' ' ' THR . 22.5 pttt -55.59 -45.94 77.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.769 0.795 . . . . 0.0 111.068 -173.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.61 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 12.6 t -57.33 -13.73 3.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.426 -1.261 . . . . 0.0 112.843 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.662 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -90.45 -37.35 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -58.09 -37.03 73.73 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.687 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.518 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -79.42 -36.48 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.38 0.609 . . . . 0.0 110.447 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.19 70.64 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.373 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.707 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 19.5 ptt? -69.59 -17.89 63.58 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.201 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 53.0 t -73.26 -22.36 60.41 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.872 ' HB2' HG22 ' A' ' 93' ' ' ILE . 54.2 t80 -81.0 -46.3 15.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.686 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.64 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.29 -17.52 63.09 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 118.309 -1.356 . . . . 0.0 109.397 175.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.707 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.47 -55.3 21.67 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.149 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 8.0 mm-40 -58.95 -51.3 70.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.642 175.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.33 -32.9 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 178.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -70.9 -32.8 69.86 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.038 -0.413 . . . . 0.0 112.057 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -73.76 -34.37 64.68 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.441 0.638 . . . . 0.0 109.959 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 79.1 mt . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.936 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo . . . . . 0 CA--C 1.528 0.196 0 CA-C-O 120.526 0.136 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -49.29 -66.47 0.39 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.044 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tp -75.36 -15.6 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 121.17 0.51 . . . . 0.0 111.517 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 73.7 mtp -76.84 -40.61 47.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -80.12 97.05 6.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.91 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -62.38 123.27 17.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.342 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.07 -36.41 77.29 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.286 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 m -60.29 -34.64 74.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -75.0 -32.76 61.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.019 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -67.92 -45.06 75.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.721 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -57.1 -86.5 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 169.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.81 37.91 44.41 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.492 -178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -61.45 -59.31 5.44 Favored 'General case' 0 C--N 1.335 -0.042 0 CA-C-O 121.227 0.536 . . . . 0.0 110.437 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.45 100.55 3.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.965 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.514 ' HG2' ' OH ' ' A' ' 34' ' ' TYR . 17.0 tpt -74.61 -22.3 59.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.759 -178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -53.89 -31.53 50.21 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.473 -175.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 26.3 mt-30 -87.42 -21.33 25.66 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.834 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 32.1 t -75.27 -36.17 61.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 170.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.545 ' HA ' HD22 ' A' ' 25' ' ' LEU . 29.7 tptp -58.27 -51.07 71.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.636 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.13 -47.79 48.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.91 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 5.8 mm-40 -69.7 -32.28 70.79 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.582 HD23 ' HB2' ' A' ' 54' ' ' CYS . 1.5 mm? -90.6 -21.46 21.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 61.91 50.28 4.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.117 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -63.12 125.7 87.48 Favored Pre-proline 0 CA--C 1.52 -0.188 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.959 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.488 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.7 Cg_exo -64.68 150.6 87.92 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.696 1.597 . . . . 0.0 109.4 168.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -54.99 -33.82 62.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.909 0.385 . . . . 0.0 111.676 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -78.58 -29.84 46.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.004 -174.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.22 -49.44 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 121.101 -0.24 . . . . 0.0 111.303 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.5 p -60.43 -27.36 39.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 121.114 0.483 . . . . 0.0 109.811 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.91 -52.02 33.77 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.699 173.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -63.65 -33.29 75.29 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.321 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.1 tp -51.02 -55.46 17.36 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.722 170.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.514 ' OH ' ' HG2' ' A' ' 16' ' ' MET . 18.4 m-85 -68.51 12.15 0.14 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 176.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.56 123.33 16.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 119.859 1.208 . . . . 0.0 110.419 -173.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -72.26 -36.24 68.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.719 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.2 m-90 -92.9 101.82 14.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.245 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -76.37 78.17 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.186 0.517 . . . . 0.0 109.896 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.536 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 34.5 t70 -62.51 12.1 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.0 t0 53.81 43.05 31.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.227 0.921 . . . . 0.0 110.047 -174.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.536 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 13.1 p90 -86.7 175.02 8.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.981 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -95.59 125.63 48.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.65 ' HE2' HD13 ' A' ' 52' ' ' ILE . 42.6 ttm -68.45 103.65 1.71 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.058 0.456 . . . . 0.0 110.251 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.9 p -93.31 -39.47 10.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.842 -174.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -83.57 134.56 34.81 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.924 0.868 . . . . 0.0 111.025 -176.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 4.2 mpt_? -74.98 -30.14 61.09 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.11 -1.404 . . . . 0.0 110.149 -173.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.504 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -66.55 -15.23 63.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.796 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.74 -56.76 3.93 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.552 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -40.33 -47.29 3.61 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-N 114.933 -1.03 . . . . 0.0 114.58 165.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 20.8 m -66.28 -44.52 83.33 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 118.786 1.293 . . . . 0.0 110.28 -178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.18 -17.3 63.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.553 -175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.65 HD13 ' HE2' ' A' ' 43' ' ' MET . 71.4 mt -54.37 -37.76 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.083 0.468 . . . . 0.0 110.22 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -143.79 71.96 1.34 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.317 0.58 . . . . 0.0 109.725 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.582 ' HB2' HD23 ' A' ' 23' ' ' LEU . 23.1 p -104.52 -45.93 4.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.385 176.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.4 tp -62.37 -47.28 84.86 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.417 -176.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.84 -16.25 51.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.904 0.383 . . . . 0.0 110.772 -173.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.524 HG21 ' CG1' ' A' ' 61' ' ' VAL . 55.3 m -84.06 -36.93 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.587 174.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.483 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 15.6 mmmt -68.31 -25.0 64.9 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.246 -0.284 . . . . 0.0 111.273 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.3 mt -64.49 -66.09 0.59 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 121.098 -0.241 . . . . 0.0 110.934 176.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -176.76 121.83 0.14 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.515 0.198 . . . . 0.0 110.744 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.524 ' CG1' HG21 ' A' ' 57' ' ' THR . 13.9 p -173.29 50.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.256 1.027 . . . . 0.0 110.267 -176.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.571 ' HA ' ' HB2' ' A' ' 69' ' ' HIS . 1.5 m -110.1 125.8 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 121.601 -0.687 . . . . 0.0 111.249 -173.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -76.78 -56.14 1.4 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.265 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.688 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 16.4 Cg_endo -98.34 -139.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.504 2.803 . . . . 0.0 112.851 -171.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.474 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 28.8 t70 -71.5 -1.5 13.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.512 -177.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.44 -65.57 0.5 Allowed Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.34 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.688 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p-10 -76.31 149.57 37.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.549 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 68.6 40.67 1.83 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.318 0.58 . . . . 0.0 111.176 174.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.571 ' HB2' ' HA ' ' A' ' 62' ' ' VAL . 8.3 p80 -74.73 69.54 1.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.511 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -82.22 -50.71 8.69 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.91 -56.16 26.34 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.837 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.68 -27.75 66.68 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.38 -36.71 66.12 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.454 0.645 . . . . 0.0 110.722 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -78.65 -37.85 41.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.68 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 18.9 t70 -66.72 -32.49 73.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.464 173.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -57.69 -42.04 82.88 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.995 0.426 . . . . 0.0 110.126 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 -34.86 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.679 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 72.7 mtm -74.42 -26.49 60.11 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 4.8 ptpp? -93.03 -18.47 22.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.714 -0.795 . . . . 0.0 110.933 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -134.53 91.44 2.78 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 124.31 -74.52 0.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.705 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -91.74 132.61 36.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.867 0.365 . . . . 0.0 111.315 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.465 ' OD1' HG21 ' A' ' 85' ' ' THR . 0.9 OUTLIER -85.11 173.57 10.36 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 15.8 mt-10 -59.59 -34.45 72.75 Favored 'General case' 0 N--CA 1.418 -2.058 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -170.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.787 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 5.2 t -63.61 -31.42 72.59 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.362 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 46.1 mtt -82.5 -39.66 22.14 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.23 -37.32 87.07 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.556 177.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -75.69 -26.17 57.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.502 -175.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 85' ' ' THR . 54.2 mm-40 -80.14 -24.26 40.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.67 172.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.468 ' O ' HG13 ' A' ' 94' ' ' ILE . 42.0 tp -84.15 -46.38 11.97 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.085 -176.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.2 m -56.88 -36.76 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.869 -176.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.58 -43.53 80.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.437 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.663 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.6 mp -69.11 -43.32 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.245 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.7 mt -55.65 -47.79 78.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.669 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -71.06 -35.16 71.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.698 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.15 -45.25 6.32 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.491 -173.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.663 ' SG ' HG23 ' A' ' 93' ' ' ILE . 60.1 m -72.65 -37.05 68.09 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.117 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.09 -39.32 93.81 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.282 0.492 . . . . 0.0 110.719 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.92 -34.15 77.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.08 0.467 . . . . 0.0 110.48 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 m -104.09 17.19 24.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.973 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.76 155.97 67.95 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.252 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.06 143.84 91.68 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.968 1.779 . . . . 0.0 110.473 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.55 72.28 0.43 Allowed 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.665 2.243 . . . . 0.0 112.908 -176.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -125.62 95.21 4.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.823 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -76.51 96.31 4.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.191 0.519 . . . . 0.0 111.321 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 1.071 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.2 t70 -143.92 120.34 10.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.756 174.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.739 ' HZ1' ' HB2' ' A' ' 107' ' ' LYS . 3.9 ttmp? -34.68 -60.84 0.42 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 178.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.485 ' O ' HD11 ' A' ' 112' ' ' ILE . 5.9 m -89.51 -10.13 47.42 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 1.071 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 1.3 tmm? -69.03 -42.97 75.65 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-O 122.214 1.007 . . . . 0.0 110.092 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.648 ' HG3' ' H ' ' A' ' 111' ' ' THR . 14.4 ptpt -64.92 -49.98 68.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.169 -1.378 . . . . 0.0 111.342 -172.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.648 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 11.6 t -57.98 -14.98 7.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.68 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.552 HD13 ' HA3' ' A' ' 49' ' ' GLY . 1.5 mp -91.66 -40.71 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.641 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 8.5 t70 -61.94 -34.91 76.96 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.078 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.645 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.1 m -81.53 -37.38 15.36 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.865 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -60.2 -51.78 68.1 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-O 120.817 0.341 . . . . 0.0 111.795 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.641 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -69.43 -26.02 64.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.015 179.635 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 32.3 t -68.52 -24.76 64.69 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.112 0.482 . . . . 0.0 109.837 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.576 ' HA ' HG12 ' A' ' 93' ' ' ILE . 37.8 t80 -77.31 -49.73 14.37 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.845 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -23.65 61.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.824 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.63 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.92 -54.43 46.27 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 118.869 0.758 . . . . 0.0 109.367 167.469 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.425 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 6.8 tp10 -58.07 -50.4 73.6 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.87 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.85 -32.89 22.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 117.742 0.246 . . . . 0.0 111.161 177.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -71.29 -32.88 69.17 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -78.47 -31.26 47.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 0.0 109.862 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 91.4 mt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.52 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo . . . . . 0 CA--C 1.528 0.191 0 N-CA-C 112.552 0.174 . . . . 0.0 112.552 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -50.03 -67.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 111.341 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.763 HD13 ' HB2' ' A' ' 82' ' ' ALA . 23.4 mm -76.17 -16.25 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 121.066 0.46 . . . . 0.0 111.326 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.2 tmm? -68.4 -43.62 76.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.521 ' HE3' ' OD1' ' A' ' 11' ' ' ASN . 41.9 tptt -80.73 85.54 6.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.356 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.459 ' OD1' ' HB2' ' A' ' 10' ' ' ASN . 3.0 p30 -62.65 125.55 24.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.218 -175.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.662 ' H ' HD22 ' A' ' 8' ' ' LEU . 1.9 pt? -61.85 -30.2 70.69 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.506 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -61.6 -41.49 97.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.796 0.331 . . . . 0.0 110.855 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.459 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m120 -78.05 -18.9 55.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.13 176.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.592 ' ND2' ' HA ' ' A' ' 8' ' ' LEU . 96.9 m-20 -66.51 -52.18 48.73 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -57.21 -84.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.941 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.54 34.79 35.7 Favored Glycine 0 C--N 1.344 0.989 0 C-N-CA 121.356 -0.45 . . . . 0.0 114.111 178.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.97 -56.27 23.75 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 117.272 0.536 . . . . 0.0 111.163 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.634 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -144.64 107.31 4.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.886 0.374 . . . . 0.0 110.879 -177.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.7 mtm -70.18 -32.5 70.47 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.747 0.308 . . . . 0.0 110.818 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.7 -22.8 67.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.915 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.634 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 3.2 pt20 -83.94 -27.02 28.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.077 -176.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.405 ' O ' HD21 ' A' ' 23' ' ' LEU . 8.8 t -75.47 -35.64 60.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.742 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.32 -48.28 80.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.043 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.75 -44.13 43.21 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.276 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -63.3 -41.82 99.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.452 0.168 . . . . 0.0 111.262 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.624 HD23 ' HB2' ' A' ' 54' ' ' CYS . 3.4 mm? -79.21 -22.82 44.34 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.8 m 60.83 50.02 5.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.301 -175.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.742 HD22 ' HA ' ' A' ' 20' ' ' LYS . 1.6 mm? -61.29 131.08 92.14 Favored Pre-proline 0 N--CA 1.461 0.122 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.521 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 5.8 Cg_exo -73.69 154.24 49.17 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.144 1.896 . . . . 0.0 110.441 168.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.579 ' HA ' HG23 ' A' ' 30' ' ' VAL . 0.9 OUTLIER -65.98 -26.98 67.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.018 0.437 . . . . 0.0 110.801 -176.077 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -63.37 -40.67 97.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.279 0.561 . . . . 0.0 110.073 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 47' ' ' LEU . 24.4 t -77.22 -43.8 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.342 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.579 HG23 ' HA ' ' A' ' 27' ' ' ASP . 27.7 m -56.02 -37.24 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 121.157 0.503 . . . . 0.0 109.997 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.19 -51.91 58.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.672 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.63 -37.1 86.41 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.163 0.506 . . . . 0.0 110.524 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -43.48 95.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.02 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.0 9.68 2.81 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -65.93 131.56 46.55 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.048 0.84 . . . . 0.0 110.666 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -91.1 -7.72 50.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.994 0.425 . . . . 0.0 110.903 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 6.9 m-90 -91.15 102.38 15.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.687 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -90.52 65.46 6.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -62.77 12.58 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.2 t0 54.54 71.52 0.52 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.559 1.072 . . . . 0.0 109.75 -169.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -115.34 157.12 24.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.245 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 67.1 t -86.2 116.15 28.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.535 ' SD ' ' HB3' ' A' ' 48' ' ' ALA . 55.3 tpp -71.26 103.71 2.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.566 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -99.94 -9.13 23.13 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -90.39 127.78 36.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 109.718 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.614 ' N ' ' HD3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -78.48 -19.59 52.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.288 -170.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.692 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -75.76 -19.37 59.07 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.228 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.535 ' HB3' ' SD ' ' A' ' 43' ' ' MET . . . -85.29 -59.07 2.43 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.42 -47.68 2.86 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-N 115.176 -0.92 . . . . 0.0 114.083 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 m -65.4 -45.49 83.78 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 118.207 1.003 . . . . 0.0 111.619 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.14 -3.06 24.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.0 mm -59.73 -35.78 61.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -145.2 82.65 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 173.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.624 ' HB2' HD23 ' A' ' 23' ' ' LEU . 21.4 p -108.79 -45.53 3.8 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.889 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 15' ' ' ALA . 6.7 tt -63.99 -44.43 92.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.932 -174.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.63 55.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.037 0.446 . . . . 0.0 110.371 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.513 HG21 ' CG1' ' A' ' 61' ' ' VAL . 43.6 m -80.9 -32.0 34.96 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.581 175.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 19.2 mmmt -82.04 -16.75 49.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.846 177.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.2 mt -66.71 -67.17 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 171.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -178.1 127.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.513 ' CG1' HG21 ' A' ' 57' ' ' THR . 9.3 p -172.56 32.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 122.109 0.957 . . . . 0.0 109.778 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.586 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.0 m -102.79 120.95 53.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 O-C-N 121.769 -0.582 . . . . 0.0 111.605 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.3 -56.78 5.06 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.427 174.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.661 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 17.8 Cg_endo -100.74 -140.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.355 2.703 . . . . 0.0 113.271 -170.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -75.3 5.49 5.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.58 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 139.75 -75.46 0.36 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -177.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.715 HD21 HD23 ' A' ' 68' ' ' LEU . 2.0 p-10 -69.07 156.77 38.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.827 -0.686 . . . . 0.0 110.901 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.715 HD23 HD21 ' A' ' 67' ' ' ASN . 4.0 mm? 70.05 29.21 3.91 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.266 0.626 . . . . 0.0 112.533 174.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.6 p-80 -78.08 67.57 3.95 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.254 0.549 . . . . 0.0 111.284 174.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 9.0 p80 -86.61 -45.74 10.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.837 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.96 -55.36 30.77 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.317 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -59.94 -28.39 67.58 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.705 -0.248 . . . . 0.0 111.488 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.62 -34.98 74.83 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.345 0.593 . . . . 0.0 110.983 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 70.5 mmtt -78.56 -37.32 43.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 109.241 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.77 -40.01 94.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.637 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -62.59 -34.06 76.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.073 177.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.08 -32.08 69.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.994 177.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 89.1 mtp -70.67 -35.14 72.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.778 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -90.28 -14.83 32.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.478 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -140.05 92.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.361 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.29 -73.59 0.46 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.876 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.763 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -104.39 145.26 30.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.959 0.409 . . . . 0.0 111.248 -175.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.636 ' OD2' HG21 ' A' ' 85' ' ' THR . 1.0 OUTLIER -87.78 177.13 7.09 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.027 175.205 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -40.45 65.56 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.38 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.724 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 13.0 t -72.12 -33.55 67.9 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.119 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.49 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 68.6 mtp -81.4 -39.15 25.43 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 121.96 -0.463 . . . . 0.0 109.886 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -60.22 -37.92 81.78 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 173.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.36 -24.93 60.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.685 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.724 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.2 mm-40 -79.87 -25.92 40.5 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.404 -0.518 . . . . 0.0 109.898 173.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.516 ' O ' HG13 ' A' ' 94' ' ' ILE . 22.7 tp -87.62 -44.2 11.4 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.954 -174.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 87' ' ' ALA . 14.5 m -57.24 -36.03 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.179 -176.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.41 -44.18 95.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.952 0.406 . . . . 0.0 110.181 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.522 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -68.32 -42.38 84.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.234 175.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 90' ' ' LEU . 57.8 mt -54.87 -49.2 72.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.307 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -70.77 -35.12 72.45 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.487 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.4 -56.39 2.84 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.26 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 21.7 m -72.73 -29.73 63.59 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.17 -34.17 76.97 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.631 0.651 . . . . 0.0 110.108 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -70.39 -42.96 71.02 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.832 0.349 . . . . 0.0 111.137 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -94.08 10.37 33.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.763 0.316 . . . . 0.0 111.688 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.435 ' HB3' ' HD2' ' A' ' 102' ' ' PRO . . . -64.53 156.3 77.93 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.47 ' C ' ' H ' ' A' ' 104' ' ' ASN . 9.8 Cg_endo -50.87 156.4 4.74 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.251 2.634 . . . . 0.0 112.464 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.7 Cg_exo -68.68 24.48 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.555 2.837 . . . . 0.0 113.496 -175.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 102' ' ' PRO . 17.0 m120 -110.79 105.12 13.86 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.54 84.95 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.159 0.504 . . . . 0.0 109.944 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.728 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.8 t70 -101.17 103.94 15.0 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.563 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -37.58 -50.39 1.14 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 114.317 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.527 ' O ' HG22 ' A' ' 111' ' ' THR . 5.4 t -95.26 -20.93 18.78 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.037 0.835 . . . . 0.0 113.189 -176.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.728 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 56.2 mmm -74.55 -29.07 61.22 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.026 0.83 . . . . 0.0 112.334 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.482 ' HG3' ' H ' ' A' ' 111' ' ' THR . 27.5 pttt -56.34 -45.45 80.39 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.492 -172.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 108' ' ' CYS . 14.6 t -57.61 -16.36 10.13 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.711 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.527 ' O ' ' HG3' ' A' ' 116' ' ' MET . 3.1 mp -90.07 -37.2 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.8 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 6.4 m-20 -59.43 -37.98 79.5 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.865 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.95 -37.45 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.55 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.01 -52.67 64.01 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.8 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -69.72 -19.73 63.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.396 178.681 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.567 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 5.0 t -71.58 -30.62 66.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.493 173.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.4 ' HA ' HG12 ' A' ' 93' ' ' ILE . 86.7 t80 -76.78 -45.95 26.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.794 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.405 ' HA ' HG23 ' A' ' 122' ' ' ILE . 3.3 pttp -70.32 -30.0 66.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.357 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.567 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -66.69 -44.44 81.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.179 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 23.9 mm-40 -59.01 -53.54 57.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.172 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.505 ' HA ' HD11 ' A' ' 125' ' ' LEU . 8.5 tt -55.74 -32.93 32.74 Favored 'Isoleucine or valine' 0 C--N 1.345 0.4 0 CA-C-N 118.023 0.374 . . . . 0.0 111.401 -178.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.495 ' N ' HG22 ' A' ' 122' ' ' ILE . 7.2 m170 -71.3 -33.37 69.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.2 ttpt -76.59 -15.58 59.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.238 0.542 . . . . 0.0 110.7 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 87.0 mt . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.601 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.637 ' O ' ' HG2' ' A' ' 6' ' ' LYS . 36.2 Cg_exo . . . . . 0 N--CA 1.473 0.267 0 N-CA-C 113.578 0.568 . . . . 0.0 113.578 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -45.02 -69.52 0.13 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.544 0.527 . . . . 0.0 112.133 -176.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.537 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -87.2 -9.09 11.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 75.4 mtp -74.93 -25.6 59.01 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' A' ' 2' ' ' PRO . 21.3 pttp -97.03 89.26 4.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.449 0.642 . . . . 0.0 109.721 173.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.02 125.18 24.09 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.003 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -59.32 -33.85 71.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.781 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -61.86 -38.07 86.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.164 0.507 . . . . 0.0 110.082 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -75.39 -30.91 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.302 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.24 -55.99 10.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.296 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -47.78 -74.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.034 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . 0.589 ' HA2' ' HG3' ' A' ' 16' ' ' MET . . . 54.65 33.48 55.03 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.219 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -68.38 -43.05 78.21 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.506 0.653 . . . . 0.0 110.189 178.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.12 66.78 1.31 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.172 0.51 . . . . 0.0 110.905 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.589 ' HG3' ' HA2' ' A' ' 13' ' ' GLY . 73.4 mtm -70.35 -25.01 63.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.78 -31.86 62.98 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.663 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -87.97 -25.37 23.2 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.059 -0.656 . . . . 0.0 111.091 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -71.46 -35.33 70.84 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.923 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.31 -52.62 62.93 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.114 -178.063 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.03 -36.95 67.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.53 -175.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -68.63 -42.27 78.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.727 0.299 . . . . 0.0 111.201 -175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.731 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 18.0 mt -84.2 -1.08 54.52 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.822 0.344 . . . . 0.0 110.664 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 63.69 36.59 10.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.304 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.923 ' HB2' ' HD3' ' A' ' 20' ' ' LYS . 1.2 mm? -49.41 119.16 8.87 Favored Pre-proline 0 N--CA 1.471 0.59 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.73 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HD2' ' CD2' ' A' ' 47' ' ' LEU . 12.7 Cg_exo -73.93 154.17 47.87 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.416 2.077 . . . . 0.0 109.861 167.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -55.79 -32.9 63.91 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -66.03 -53.02 43.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.855 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.568 ' CB ' HD21 ' A' ' 47' ' ' LEU . 36.0 t -70.35 -50.68 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.718 -176.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.498 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 8.8 p -59.7 -33.4 51.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.152 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.93 -51.17 58.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.556 177.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.92 -32.58 73.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.064 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.6 tp -48.44 -55.38 11.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.081 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.92 13.39 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.466 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 52.0 t30 -53.86 122.31 9.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 119.521 1.055 . . . . 0.0 111.803 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -71.79 -33.15 68.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.917 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 31.0 m-90 -79.04 145.41 33.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.14 0.495 . . . . 0.0 110.965 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.65 54.28 2.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.462 -173.516 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.509 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 27.7 t70 -43.52 -42.59 5.03 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.9 t70 63.08 70.44 0.54 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 118.861 0.755 . . . . 0.0 109.853 -175.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.509 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 1.5 p90 -106.3 175.5 5.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.8 -175.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.422 HG12 HG21 ' A' ' 44' ' ' THR . 93.6 t -84.1 125.14 40.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.754 174.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttp -77.71 96.03 4.77 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.214 0.531 . . . . 0.0 110.226 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.422 HG21 HG12 ' A' ' 42' ' ' VAL . 9.4 p -103.42 -39.11 6.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.755 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -69.42 124.85 24.96 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.74 0.781 . . . . 0.0 110.07 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.549 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 2.5 mpt_? -79.89 -28.06 39.92 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.717 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.582 HD23 HD11 ' A' ' 25' ' ' LEU . 7.4 tp -69.61 -19.06 63.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.948 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.562 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -78.37 -60.61 2.3 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.91 -46.78 1.78 Allowed Glycine 0 CA--C 1.534 1.227 0 CA-C-N 114.399 -1.273 . . . . 0.0 114.654 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 74.2 m -66.85 -43.61 83.2 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.522 1.161 . . . . 0.0 110.619 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.5 -22.07 66.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.761 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 48' ' ' ALA . 47.8 mm -61.83 -36.23 72.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-O 120.903 0.382 . . . . 0.0 111.127 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -122.2 76.88 1.34 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.557 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.7 p -125.19 -47.29 1.76 Allowed 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.301 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.9 tt -63.53 -65.51 0.67 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 111.786 -168.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.15 -12.47 59.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.252 0.548 . . . . 0.0 110.016 -174.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.511 ' HA ' HG12 ' A' ' 61' ' ' VAL . 56.3 m -83.9 -33.05 24.83 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.726 176.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.503 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 8.1 mmmt -75.35 -23.44 57.2 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.363 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.5 mt -63.79 -66.28 0.56 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.571 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -177.4 123.96 0.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.511 HG12 ' HA ' ' A' ' 57' ' ' THR . 10.4 p -178.67 34.57 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.99 0.9 . . . . 0.0 110.139 -174.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.693 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 28.1 m -98.82 114.02 35.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.802 0.811 . . . . 0.0 112.227 -170.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.23 -56.31 10.99 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.954 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.566 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 13.6 Cg_endo -97.91 -138.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 123.311 2.674 . . . . 0.0 113.254 -170.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.2 m-20 -72.24 2.39 6.06 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.622 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.19 -75.92 0.3 Allowed Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.566 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.8 p-10 -75.17 170.91 15.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.803 -0.699 . . . . 0.0 110.317 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 69.66 29.79 4.11 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.519 0.512 . . . . 0.0 111.621 173.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.693 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 3.5 p80 -73.11 79.89 1.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.392 0.615 . . . . 0.0 110.984 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -85.1 -58.85 2.52 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.651 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.0 -61.49 6.37 Favored Glycine 0 N--CA 1.443 -0.867 0 C-N-CA 121.154 -0.545 . . . . 0.0 113.171 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -54.1 -36.02 62.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.434 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -71.55 -37.89 71.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.204 0.525 . . . . 0.0 111.337 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HZ2' HG23 ' A' ' 94' ' ' ILE . 92.2 mttt -81.37 -30.45 33.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.002 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.13 -41.64 94.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.144 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.857 ' HD1' ' HE2' ' A' ' 80' ' ' HIS . 2.5 m-85 -62.57 -36.65 83.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.857 176.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.9 -40.27 75.73 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.639 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.621 ' HB3' ' CB ' ' A' ' 87' ' ' ALA . 1.7 ptt? -76.92 -14.87 59.82 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.635 ' HG3' ' HD2' ' A' ' 80' ' ' HIS . 18.5 ptpt -90.88 -18.61 24.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.126 173.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.857 ' HE2' ' HD1' ' A' ' 76' ' ' PHE . 12.3 p80 -149.77 99.49 2.86 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.683 0.278 . . . . 0.0 111.565 172.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.18 -75.97 0.41 Allowed Glycine 0 C--O 1.234 0.123 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.099 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.598 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.22 149.94 22.88 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.642 ' OD2' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -88.7 167.4 13.36 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.583 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -72.56 -23.31 60.96 Favored 'General case' 0 N--CA 1.421 -1.907 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.716 -166.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.642 ' HB ' ' OD2' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -73.29 -34.35 65.71 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.338 176.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.41 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 3.3 tpt -77.27 -43.52 33.02 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.111 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.621 ' CB ' ' HB3' ' A' ' 78' ' ' MET . . . -65.24 -41.59 94.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.353 175.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.583 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -69.23 -26.25 64.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -175.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 86' ' ' MET . 28.7 pt20 -82.78 -28.9 29.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.844 175.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -76.93 -46.73 23.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.433 ' HA ' HD12 ' A' ' 94' ' ' ILE . 25.4 m -57.69 -35.9 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.892 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.21 -44.51 88.06 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.924 0.392 . . . . 0.0 110.567 -176.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.514 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.2 mp -60.21 -42.66 91.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.455 174.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.607 HG23 ' HZ2' ' A' ' 74' ' ' LYS . 59.6 mt -55.25 -47.17 78.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.312 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -67.07 -31.45 71.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.429 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.404 ' O ' ' HB3' ' A' ' 99' ' ' LYS . . . -80.97 -50.67 5.08 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.374 -173.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 13.8 m -73.61 -32.75 64.24 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.171 -0.612 . . . . 0.0 112.21 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.533 ' CD ' ' HZ1' ' A' ' 110' ' ' LYS . 8.7 tp10 -57.89 -38.48 75.87 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.434 0.561 . . . . 0.0 110.416 168.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 96' ' ' GLY . 31.8 ttpt -63.48 -40.85 98.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.592 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.8 m -102.11 24.41 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.305 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.69 152.92 49.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.87 162.19 43.08 Favored 'Trans proline' 0 CA--C 1.529 0.249 0 C-N-CA 122.578 2.186 . . . . 0.0 112.275 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -69.2 59.01 1.33 Allowed 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.402 2.735 . . . . 0.0 112.587 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -103.93 113.28 26.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.504 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -79.0 16.31 0.94 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.805 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.1 t70 -90.85 112.18 23.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.093 0.473 . . . . 0.0 110.581 -176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.47 -54.25 3.17 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.636 ' O ' HD11 ' A' ' 112' ' ' ILE . 68.4 m -83.33 -21.91 33.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.371 0.987 . . . . 0.0 112.187 -176.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.805 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 5.7 mmm -63.33 -44.54 94.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.161 0.505 . . . . 0.0 110.57 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.64 ' HA ' ' OD2' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -66.17 -49.26 67.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.058 -177.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.499 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.64 -13.83 4.53 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.98 175.183 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.636 HD11 ' O ' ' A' ' 108' ' ' CYS . 1.2 mp -91.06 -41.56 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 O-C-N 121.933 -0.479 . . . . 0.0 110.03 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.64 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 3.2 p30 -63.08 -34.15 76.97 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.494 177.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.574 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 18.8 m -80.09 -36.31 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.49 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -61.53 -50.5 72.42 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 121.701 0.763 . . . . 0.0 111.339 176.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.74 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.3 ptt? -68.72 -17.75 64.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.784 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.574 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 25.8 t -71.92 -30.55 65.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.601 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.514 ' HA ' HG12 ' A' ' 93' ' ' ILE . 85.4 t80 -72.04 -44.91 62.6 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.776 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -29.25 66.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 118.139 -1.424 . . . . 0.0 111.276 179.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.74 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.61 -56.21 19.15 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.756 170.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.53 -51.04 71.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.409 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.453 HD11 HG21 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -57.23 -32.79 41.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 118.22 0.464 . . . . 0.0 111.287 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -71.98 -31.9 66.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.455 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -79.05 -36.19 41.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.332 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.568 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 2.6 Cg_exo . . . . . 0 CA--C 1.534 0.494 0 N-CA-C 114.921 1.085 . . . . 0.0 114.921 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -49.06 -70.57 0.09 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.43 HD11 ' HB2' ' A' ' 82' ' ' ALA . 7.9 tp -86.31 -9.47 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 121.124 0.488 . . . . 0.0 111.467 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.568 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 85.3 mtp -77.71 -30.6 51.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.959 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.596 ' HE2' HD22 ' A' ' 11' ' ' ASN . 82.2 tttt -84.7 94.37 8.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.219 0.533 . . . . 0.0 109.838 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -71.94 115.6 11.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.182 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.579 ' H ' HD12 ' A' ' 8' ' ' LEU . 5.8 mp -58.48 -37.73 76.14 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.342 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.546 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 6.1 p -65.08 -28.74 69.67 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.96 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.98 -26.51 56.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.894 175.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.596 HD22 ' HE2' ' A' ' 6' ' ' LYS . 5.1 m-20 -66.82 -45.66 77.59 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.546 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 67.9 m-85 -55.23 -84.37 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.381 171.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.02 36.79 15.33 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.688 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -66.34 -37.62 85.75 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.812 0.339 . . . . 0.0 111.012 -177.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.14 92.23 2.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.071 0.462 . . . . 0.0 109.85 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttp -71.32 -33.08 69.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.0 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.0 -29.3 65.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.064 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -88.52 -21.23 24.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.876 -172.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.9 t -74.85 -36.17 62.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.67 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -63.49 -45.56 90.17 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.384 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.84 -47.63 58.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.87 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.9 tp10 -67.96 -40.69 83.15 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.406 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 2.2 mm? -77.81 -21.52 51.43 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 61.67 48.16 5.83 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.843 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.67 HD22 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -61.29 128.34 89.52 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.359 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.606 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.4 Cg_exo -66.46 149.85 84.42 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.812 1.675 . . . . 0.0 109.694 170.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -61.06 -31.65 71.3 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 121.152 -0.219 . . . . 0.0 110.975 -175.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.4 m -66.46 -46.39 76.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.875 0.369 . . . . 0.0 110.801 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.3 t -71.38 -52.73 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.626 -176.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 5.0 p -60.2 -34.97 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.871 -175.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.36 -51.52 59.88 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.94 0.4 . . . . 0.0 111.267 177.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.68 -37.46 76.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.578 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.52 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 1.6 pp -59.81 -30.64 69.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.536 177.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -62.86 9.8 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 174.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -56.03 110.18 0.7 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 120.474 1.488 . . . . 0.0 111.367 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -76.48 -14.96 60.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.059 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -88.2 157.95 18.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -87.07 53.6 2.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.779 0.8 . . . . 0.0 109.959 175.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.577 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 10.6 t70 -42.78 -45.5 4.84 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.818 177.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 63.04 70.47 0.55 Allowed 'General case' 0 C--N 1.347 0.481 0 CA-C-O 121.639 0.733 . . . . 0.0 109.85 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.577 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 14.9 p90 -109.76 164.05 12.93 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.305 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 38.2 t -84.17 113.91 23.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.516 ' HB3' HG23 ' A' ' 112' ' ' ILE . 38.6 ttm -70.99 104.32 2.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.17 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -108.22 -18.43 13.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.392 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.15 139.68 30.39 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.94 0.876 . . . . 0.0 111.382 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HA ' ' HG2' ' A' ' 109' ' ' MET . 6.7 mpt_? -70.72 -32.65 69.91 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.898 -1.501 . . . . 0.0 110.608 -171.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.607 ' HB3' HD12 ' A' ' 25' ' ' LEU . 4.3 mm? -73.62 -15.07 61.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.968 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.64 -61.03 2.09 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.74 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -40.11 -48.01 3.48 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.079 -0.964 . . . . 0.0 114.586 168.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 m -66.15 -42.66 88.72 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.495 1.148 . . . . 0.0 111.56 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.94 -23.14 67.25 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.2 mm -55.79 -38.35 51.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.053 0.454 . . . . 0.0 110.329 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.405 ' HB2' ' HG1' ' A' ' 57' ' ' THR . 5.1 p30 -131.27 81.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.214 1.007 . . . . 0.0 110.142 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.404 ' SG ' HD23 ' A' ' 23' ' ' LEU . 1.5 t -114.58 -47.19 2.92 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.706 -176.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.33 -68.02 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.016 0.436 . . . . 0.0 111.195 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.55 -10.46 59.45 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.087 0.47 . . . . 0.0 110.612 -172.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.943 HG21 HG12 ' A' ' 61' ' ' VAL . 51.7 m -78.8 -35.8 43.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 174.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -80.64 -17.31 51.65 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.514 176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 55' ' ' LEU . 3.8 mm? -63.93 -60.16 3.61 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.127 170.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -176.02 116.86 0.13 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.603 0.24 . . . . 0.0 110.848 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.943 HG12 HG21 ' A' ' 57' ' ' THR . 9.2 p -155.0 31.37 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.515 0.674 . . . . 0.0 110.501 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.657 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.4 m -107.84 121.65 61.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 O-C-N 121.761 -0.587 . . . . 0.0 111.901 -174.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -76.2 -57.49 1.39 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.218 174.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.749 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 65.9 Cg_endo -104.18 -138.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.768 2.979 . . . . 0.0 113.596 -167.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.468 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.8 m-20 -72.2 12.01 0.5 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.895 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.56 -74.59 0.39 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.561 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -70.28 153.12 43.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.249 -0.475 . . . . 0.0 110.386 176.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.58 36.69 2.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.384 0.611 . . . . 0.0 110.645 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 8.5 p80 -72.37 79.88 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.535 0.683 . . . . 0.0 111.045 175.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -86.94 -60.38 2.0 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.085 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.78 -62.26 6.3 Favored Glycine 0 CA--C 1.507 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 113.115 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -59.14 -23.54 62.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.09 64.95 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.272 0.558 . . . . 0.0 110.769 178.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.745 ' HE2' HG13 ' A' ' 91' ' ' VAL . 32.0 mmmt -80.3 -32.5 38.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.823 177.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.48 -39.9 94.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.685 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -63.49 -42.81 98.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.628 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.04 -37.78 72.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.611 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.1 mtm -69.92 -32.13 70.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.601 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 16.9 tptm -93.25 -10.32 36.01 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.822 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.486 ' HB3' HD23 ' A' ' 8' ' ' LEU . 75.7 m-70 -141.96 89.74 2.21 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 122.076 -0.39 . . . . 0.0 110.85 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 127.35 -68.17 0.54 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.793 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.43 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -106.34 140.85 38.62 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.851 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.37 159.65 29.35 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -61.6 -49.83 75.03 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.744 -164.765 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 7.0 t -60.14 -28.7 68.11 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.959 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.7 tpt -79.86 -46.24 17.21 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.48 0.657 . . . . 0.0 109.735 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.585 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -57.65 -35.78 70.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.805 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.6 mp0 -73.12 -25.17 60.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.594 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.0 mm-40 -75.65 -23.54 56.3 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 172.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.635 ' O ' HG13 ' A' ' 94' ' ' ILE . 36.3 tp -84.98 -41.98 15.35 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.255 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.745 HG13 ' HE2' ' A' ' 74' ' ' LYS . 35.1 m -57.6 -35.81 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -66.22 -44.12 84.73 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.232 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.4 mp -62.11 -44.18 98.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.606 173.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.635 HG13 ' O ' ' A' ' 90' ' ' LEU . 39.2 mt -51.89 -47.06 41.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-O 120.716 0.293 . . . . 0.0 110.526 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.53 -36.6 73.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.923 0.392 . . . . 0.0 110.641 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.59 -42.32 7.87 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 119.979 -1.105 . . . . 0.0 112.004 -173.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.418 ' HB2' ' HB ' ' A' ' 114' ' ' VAL . 55.2 m -73.23 -41.44 63.73 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.499 ' HG2' HG12 ' A' ' 114' ' ' VAL . 24.1 mm-40 -56.68 -38.73 72.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.45 171.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -69.68 -42.73 73.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.755 0.312 . . . . 0.0 111.661 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.0 m -96.86 8.01 45.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.37 149.83 94.11 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 104' ' ' ASN . 50.1 Cg_exo -56.04 164.85 4.48 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.111 2.541 . . . . 0.0 112.265 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 38.63 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.437 2.758 . . . . 0.0 113.212 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 102' ' ' PRO . 5.2 m-20 -99.45 104.98 16.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.718 176.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.83 87.05 4.71 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.4 t0 -112.05 104.23 12.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.279 -174.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -35.69 -76.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 124.595 1.184 . . . . 0.0 113.787 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.1 t -94.99 -15.59 23.41 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.559 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 1.9 mmm -86.02 -22.99 26.98 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -168.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.57 -38.6 81.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 122.069 0.938 . . . . 0.0 110.076 -175.367 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.797 HG21 HD12 ' A' ' 112' ' ' ILE . 0.6 OUTLIER -56.27 -16.86 6.1 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.101 -1.409 . . . . 0.0 112.291 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.797 HD12 HG21 ' A' ' 111' ' ' THR . 1.8 mp -91.17 -36.74 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -58.72 -37.1 75.42 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.199 176.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.605 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 4.8 m -80.71 -32.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.656 0.741 . . . . 0.0 109.971 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.57 -48.93 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.746 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.0 ptt? -69.18 -13.65 62.53 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.366 177.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.869 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 52.5 t -73.64 -31.75 63.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.758 173.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.449 ' HA ' HG12 ' A' ' 93' ' ' ILE . 74.2 t80 -74.17 -47.1 38.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.173 177.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.45 -23.99 63.74 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 118.492 -1.283 . . . . 0.0 110.163 -178.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.869 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 25.0 ttpt -56.73 -54.09 50.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.017 0.437 . . . . 0.0 110.314 166.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -58.73 -48.81 79.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.539 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.428 HG22 ' N ' ' A' ' 123' ' ' HIS . 10.7 tt -58.44 -30.13 40.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 CA-C-N 118.361 0.528 . . . . 0.0 110.762 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.428 ' N ' HG22 ' A' ' 122' ' ' ILE . 6.2 m170 -71.28 -32.52 68.77 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.662 ' HE3' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.82 -33.72 74.3 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.433 0.635 . . . . 0.0 109.783 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.516 175.665 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.486 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 36.9 Cg_exo . . . . . 0 N--CA 1.471 0.204 0 N-CA-C 112.761 0.254 . . . . 0.0 112.761 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -50.79 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.851 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.2 tt -83.16 -9.85 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.345 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.486 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.1 ttt -66.32 -28.66 68.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.244 0.545 . . . . 0.0 109.887 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -83.6 100.24 10.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.754 172.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.507 ' HB2' HD21 ' A' ' 10' ' ' ASN . 17.5 m120 -61.8 137.8 58.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.524 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.2 mt -54.18 -34.53 60.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.201 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.6 p -62.16 -40.75 97.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.277 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.507 HD21 ' HB2' ' A' ' 7' ' ' ASN . 56.9 m-80 -77.12 -30.45 55.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -68.21 -55.34 12.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -57.56 -82.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 170.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.19 36.35 35.93 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.804 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -69.37 -49.62 53.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.198 0.499 . . . . 0.0 110.383 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.506 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -153.8 105.39 2.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.488 178.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 54.7 ttp -75.47 -21.78 57.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.254 0.55 . . . . 0.0 110.194 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -63.03 -23.91 67.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.716 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.666 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 21.0 pt20 -84.56 -25.69 28.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.335 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.0 m -75.25 -35.45 61.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.481 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.09 -49.5 74.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.209 -178.096 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -70.62 -43.09 69.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.424 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.5 tm-20 -62.0 -44.29 97.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.966 -175.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 23' ' ' LEU . 15.2 mt -81.98 -13.65 57.14 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.637 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.0 m 57.64 38.36 27.69 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.091 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.602 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 19.2 mt -51.01 120.94 14.66 Favored Pre-proline 0 N--CA 1.465 0.325 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.093 -174.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.3 Cg_exo -69.05 154.46 70.53 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.165 1.91 . . . . 0.0 111.036 174.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.62 ' HA ' HG23 ' A' ' 30' ' ' VAL . 6.3 p-10 -65.63 -27.34 68.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.678 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -64.64 -40.52 95.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 109.566 174.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.625 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.3 t -72.85 -50.1 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.234 -177.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.62 HG23 ' HA ' ' A' ' 27' ' ' ASP . 16.8 m -54.98 -30.75 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 120.876 0.369 . . . . 0.0 110.21 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.21 -51.53 63.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.554 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -70.62 -39.22 73.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.453 0.644 . . . . 0.0 109.748 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 2.7 tm? -51.25 -54.35 26.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.576 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.24 9.66 0.07 Allowed 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -66.67 104.27 1.26 Allowed 'General case' 0 C--N 1.345 0.404 0 CA-C-N 120.332 1.423 . . . . 0.0 109.483 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -86.49 -20.16 28.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.512 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -90.27 142.32 27.84 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.439 0.638 . . . . 0.0 110.894 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.602 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -80.64 65.73 5.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.092 -171.858 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -62.39 -27.4 69.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.656 170.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.5 t70 63.09 70.66 0.54 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.593 0.711 . . . . 0.0 109.563 -172.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.4 p90 -95.63 163.15 13.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.082 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.8 t -87.97 121.64 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.56 ' HB3' HG23 ' A' ' 112' ' ' ILE . 43.4 tpp -76.45 104.68 7.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.474 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 p -110.13 -4.79 15.59 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.76 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -96.4 131.45 42.94 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 110.443 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 8.8 mpt_? -73.02 -23.9 60.67 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.87 -171.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.625 ' HB2' HG11 ' A' ' 29' ' ' VAL . 3.8 mm? -78.16 -18.12 55.95 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.055 0.455 . . . . 0.0 109.928 -177.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.532 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -85.16 -55.81 3.86 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -175.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.44 -48.32 2.94 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.939 165.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.7 m -64.12 -42.02 97.01 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.143 0.971 . . . . 0.0 111.667 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.1 mm -63.77 -29.74 48.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.963 0.411 . . . . 0.0 111.34 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -135.8 44.49 2.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.933 0.397 . . . . 0.0 111.362 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.539 ' SG ' HD12 ' A' ' 55' ' ' LEU . 24.6 p -94.27 -36.15 12.12 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.539 HD12 ' SG ' ' A' ' 54' ' ' CYS . 8.6 mp -56.41 -69.67 0.14 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -170.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.75 -8.8 59.73 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.061 0.458 . . . . 0.0 110.777 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.589 ' HA ' HG12 ' A' ' 61' ' ' VAL . 55.8 m -80.47 -35.16 35.23 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.297 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.479 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 16.9 mmmt -77.64 -21.84 51.63 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.4 173.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.9 mt -65.05 -65.84 0.62 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.814 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.16 119.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.589 HG12 ' HA ' ' A' ' 57' ' ' THR . 10.6 p -178.4 34.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.613 0.72 . . . . 0.0 111.13 -177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.649 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.7 m -102.24 118.78 49.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.953 -1.092 . . . . 0.0 111.256 -173.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.16 -56.01 14.33 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.265 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.609 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 8.7 Cg_endo -95.01 -139.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.009 2.473 . . . . 0.0 112.854 -171.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.524 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 3.8 m-20 -76.27 11.18 1.63 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.587 -176.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.8 -75.41 0.4 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.523 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.609 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.9 p-10 -75.33 159.3 31.62 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.03 -0.585 . . . . 0.0 111.158 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.598 HD23 HD21 ' A' ' 67' ' ' ASN . 4.6 mm? 68.95 43.24 1.18 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.255 0.55 . . . . 0.0 111.967 174.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.649 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 6.7 p80 -83.34 76.0 9.94 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.476 0.655 . . . . 0.0 110.693 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -86.86 -61.93 1.62 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.814 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.15 -52.8 51.2 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.619 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -56.94 -34.68 68.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.286 . . . . 0.0 111.579 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.12 -36.15 74.6 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.184 0.516 . . . . 0.0 111.224 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.42 ' N ' ' HD2' ' A' ' 74' ' ' LYS . 21.1 mmmt -79.82 -35.18 38.78 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 33.3 t70 -64.18 -35.44 80.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.648 173.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.495 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 52.0 t80 -62.26 -35.27 78.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.485 176.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.21 72.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.856 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -68.2 -39.05 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.639 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.637 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 34.3 pttt -93.29 -5.95 48.58 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.227 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.637 ' CD2' ' HG3' ' A' ' 79' ' ' LYS . 66.6 m-70 -136.06 88.9 2.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.629 0.252 . . . . 0.0 110.75 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.22 -75.09 0.36 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.802 172.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -99.56 132.59 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.896 0.379 . . . . 0.0 111.331 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.462 ' OD2' HG21 ' A' ' 85' ' ' THR . 6.5 p-10 -79.21 172.36 13.91 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.62 -45.68 77.48 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -164.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.744 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 11.3 t -53.66 -40.69 66.1 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.439 ' HE3' ' OD1' ' A' ' 83' ' ' ASP . 58.9 mtm -82.24 -38.22 24.81 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.111 0.482 . . . . 0.0 109.701 -174.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.58 76.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.165 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.76 -24.93 59.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.997 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.744 ' HG2' ' O ' ' A' ' 85' ' ' THR . 66.0 mm-40 -77.88 -23.49 48.77 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.532 ' O ' HG13 ' A' ' 94' ' ' ILE . 64.1 tp -88.3 -48.26 7.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.293 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 17.1 m -57.22 -38.13 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -172.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -68.14 -43.38 78.45 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.389 0.614 . . . . 0.0 110.363 -175.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.793 HG23 ' HB2' ' A' ' 117' ' ' CYS . 1.7 mp -61.8 -43.01 96.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.713 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.6 mt -55.64 -47.05 79.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.223 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -65.67 -34.71 78.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.505 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.71 -60.19 2.23 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.389 -169.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.766 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 8.8 p -74.01 -27.31 60.9 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.041 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.579 ' CB ' HG12 ' A' ' 114' ' ' VAL . 2.1 tm-20 -65.27 -38.25 89.71 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 118.576 -1.25 . . . . 0.0 109.783 171.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -64.74 -43.29 93.82 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.878 176.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -103.54 26.12 8.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.912 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.62 155.61 92.57 Favored Pre-proline 0 C--O 1.235 0.328 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.502 ' C ' ' H ' ' A' ' 104' ' ' ASN . 53.3 Cg_exo -53.69 164.99 1.95 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.003 2.468 . . . . 0.0 112.482 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.79 31.24 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.499 2.799 . . . . 0.0 113.169 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.502 ' H ' ' C ' ' A' ' 102' ' ' PRO . 4.6 m-20 -122.17 94.79 4.41 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.578 176.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.38 92.88 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.404 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.2 t70 -91.01 104.59 17.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.324 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -34.73 -74.35 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -167.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 27.7 t -90.82 -9.72 45.41 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.846 -0.533 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.404 ' HB2' ' OD1' ' A' ' 106' ' ' ASP . 3.0 mmm -87.74 -22.04 24.82 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -168.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.636 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -55.12 -45.85 75.57 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.703 0.763 . . . . 0.0 110.82 -173.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.636 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -53.97 -14.91 1.15 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.114 -1.403 . . . . 0.0 113.112 177.544 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.56 HG23 ' HB3' ' A' ' 43' ' ' MET . 1.7 mp -92.02 -39.06 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.667 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 15.5 t70 -58.42 -38.48 77.51 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 175.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.82 ' HA ' ' SG ' ' A' ' 117' ' ' CYS . 3.6 m -82.5 -34.07 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 CA-C-O 122.2 1.0 . . . . 0.0 110.347 -176.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.74 -43.38 90.22 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.72 173.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.667 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 22.5 ptt? -68.36 -20.01 64.68 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.301 -0.96 . . . . 0.0 112.111 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.82 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 1.4 m -66.85 -30.5 70.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 118.844 0.747 . . . . 0.0 109.228 170.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.05 -46.36 57.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.556 ' HE2' ' HB2' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.58 -21.97 62.62 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.57 177.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.814 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.22 -48.87 77.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 169.245 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.4 -52.12 66.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.09 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.423 HD11 HG21 ' A' ' 122' ' ' ILE . 0.4 OUTLIER -56.95 -35.68 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 117.726 0.239 . . . . 0.0 110.906 177.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -72.72 -17.57 61.6 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.07 -35.02 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 122.022 -0.424 . . . . 0.0 110.576 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 C--N 1.326 -0.447 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.239 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 113.243 0.439 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -51.62 -74.17 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.776 HD11 ' HB2' ' A' ' 82' ' ' ALA . 27.3 mm -91.03 -16.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.005 0.431 . . . . 0.0 111.89 177.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.5 tpt -69.73 -34.81 74.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -100.27 105.32 16.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.431 ' OD1' ' HB2' ' A' ' 9' ' ' SER . 6.1 t-20 -61.55 112.57 2.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.868 -174.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 8' ' ' LEU . 2.4 pt? -64.57 -23.22 67.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.433 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.431 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m -63.65 -40.23 96.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.057 0.456 . . . . 0.0 109.84 175.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.95 -30.14 58.55 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.64 -51.97 43.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -56.44 -79.48 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.642 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.81 39.85 40.38 Favored Glycine 0 C--N 1.346 1.137 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.338 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.502 ' HB3' ' HZ2' ' A' ' 14' ' ' LYS . 2.5 mmmp? -62.79 -42.45 99.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.863 0.332 . . . . 0.0 111.665 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.716 ' H ' HD23 ' A' ' 55' ' ' LEU . . . -144.55 105.01 4.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.059 0.456 . . . . 0.0 111.403 -177.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttm -75.45 -42.11 54.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.263 0.554 . . . . 0.0 110.76 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -63.36 -22.66 67.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.644 -175.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -88.0 -25.37 23.17 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.92 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.495 ' O ' HD21 ' A' ' 23' ' ' LEU . 14.7 m -71.91 -33.85 68.63 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 170.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -58.88 -55.28 37.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.911 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.1 -44.45 65.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.039 -174.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.681 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 19.6 tp10 -64.59 -39.27 93.43 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.713 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 4.4 mm? -82.43 -19.71 38.44 Favored 'General case' 0 CA--C 1.514 -0.435 0 O-C-N 122.213 -0.305 . . . . 0.0 110.479 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m 61.63 46.76 6.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -168.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HG ' ' HB2' ' A' ' 23' ' ' LEU . 20.5 mt -62.72 121.59 68.91 Favored Pre-proline 0 N--CA 1.453 -0.32 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.067 -170.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 24.0 Cg_exo -61.54 149.67 88.72 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.115 1.877 . . . . 0.0 110.427 176.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -59.97 -35.16 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.744 0.306 . . . . 0.0 110.973 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.3 m -69.16 -39.4 78.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.507 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.673 HG11 ' OD2' ' A' ' 45' ' ' ASP . 80.7 t -74.23 -52.97 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.719 -177.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.538 HG12 ' N ' ' A' ' 31' ' ' ALA . 9.9 p -57.53 -37.02 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.175 0.512 . . . . 0.0 110.273 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.538 ' N ' HG12 ' A' ' 30' ' ' VAL . . . -65.4 -51.33 61.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.221 177.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -71.78 -23.46 61.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.054 0.455 . . . . 0.0 110.716 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.63 -50.75 69.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.455 ' CE2' HG23 ' A' ' 30' ' ' VAL . 10.0 m-85 -77.28 10.61 2.36 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -57.54 130.49 46.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -72.46 -37.18 68.58 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -171.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 45.1 p90 -92.34 131.69 37.33 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.415 178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.413 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -89.38 73.31 7.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.546 0.689 . . . . 0.0 110.57 -178.129 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.486 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 36.3 t70 -42.7 -33.32 0.71 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.7 t0 67.2 51.27 0.93 Allowed 'General case' 0 C--N 1.348 0.531 0 CA-C-O 122.186 0.993 . . . . 0.0 109.715 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.486 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -91.62 178.03 6.04 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.159 174.431 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.421 ' O ' HG23 ' A' ' 44' ' ' THR . 25.7 t -83.33 117.93 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.682 ' HE2' HG13 ' A' ' 112' ' ' ILE . 29.4 ttp -67.65 92.85 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.185 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.421 HG23 ' O ' ' A' ' 42' ' ' VAL . 66.5 p -95.91 -8.78 33.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.527 -174.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.673 ' OD2' HG11 ' A' ' 29' ' ' VAL . 10.7 t70 -97.08 134.58 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.267 0.556 . . . . 0.0 111.503 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.605 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 6.2 mpt_? -76.31 -21.1 56.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.119 -174.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.586 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 3.9 mm? -79.64 -15.23 57.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.212 -176.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.41 -61.87 1.73 Allowed 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -176.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.766 ' HA3' HD12 ' A' ' 112' ' ' ILE . . . -42.45 -48.01 5.75 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.402 168.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 m -67.27 -44.46 79.26 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.581 1.191 . . . . 0.0 111.823 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.42 36.95 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.015 -0.428 . . . . 0.0 111.701 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.92 -29.37 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.426 ' O ' ' HB ' ' A' ' 57' ' ' THR . 23.3 t-20 -146.25 70.81 1.23 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.406 0.622 . . . . 0.0 110.707 175.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 58' ' ' LYS . 8.9 p -98.36 -41.77 7.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.901 174.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.716 HD23 ' H ' ' A' ' 15' ' ' ALA . 1.7 tm? -55.87 -66.0 0.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.057 0.456 . . . . 0.0 111.068 -176.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -82.75 -16.38 48.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.584 -169.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.482 HG21 ' CG2' ' A' ' 61' ' ' VAL . 23.7 m -84.16 -39.62 19.19 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.788 174.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.681 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 22.8 mmtt -81.62 -2.55 50.6 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.063 -0.398 . . . . 0.0 111.567 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 9.8 mt -64.99 -67.65 0.42 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.505 166.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -178.9 101.33 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.114 0.259 . . . . 0.0 110.978 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.482 ' CG2' HG21 ' A' ' 57' ' ' THR . 30.4 m -148.95 50.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-O 121.35 0.595 . . . . 0.0 111.169 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.636 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 5.9 m -99.9 120.58 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.85 -0.531 . . . . 0.0 110.915 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.456 ' H ' ' HB2' ' A' ' 69' ' ' HIS . 1.8 t70 -75.2 -57.73 1.66 Allowed Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.628 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 19.4 Cg_endo -98.68 -139.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.237 2.624 . . . . 0.0 113.058 -168.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.406 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 4.0 m-20 -72.63 10.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.244 -176.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.81 -70.02 0.52 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.703 HD21 HD21 ' A' ' 68' ' ' LEU . 2.5 p-10 -75.09 154.43 37.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.86 -0.67 . . . . 0.0 111.468 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.703 HD21 HD21 ' A' ' 67' ' ' ASN . 4.6 mm? 68.99 33.78 3.34 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.695 172.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.636 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.1 p80 -79.68 69.87 6.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.914 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.569 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 2.5 p-80 -85.67 -33.24 21.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.249 177.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.41 -62.84 4.75 Favored Glycine 0 CA--C 1.511 -0.216 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.382 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -57.52 -30.49 65.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.61 -0.295 . . . . 0.0 111.532 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.73 -36.39 65.18 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.178 0.514 . . . . 0.0 111.372 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 24.4 mmmt -80.37 -35.03 35.96 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.18 -38.8 90.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.587 ' CZ ' ' HB1' ' A' ' 56' ' ' ALA . 48.8 t80 -56.11 -43.42 78.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.923 175.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.55 -34.02 71.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.969 0.414 . . . . 0.0 111.212 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.452 ' HE1' ' HB3' ' A' ' 87' ' ' ALA . 67.0 mtt -74.6 -34.86 62.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.669 -179.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.893 ' HE2' ' HA ' ' A' ' 79' ' ' LYS . 9.5 mmpt? -91.37 -10.13 42.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.551 -0.459 . . . . 0.0 111.138 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -143.5 93.87 2.53 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 128.83 -75.5 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.543 174.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.776 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -98.36 151.41 20.56 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.537 0.208 . . . . 0.0 110.743 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.59 ' OD2' HG21 ' A' ' 85' ' ' THR . 1.4 p-10 -91.84 172.95 8.12 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -58.04 -38.08 75.6 Favored 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -170.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 8.0 t -62.44 -35.95 80.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.526 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.434 ' O ' HD11 ' A' ' 90' ' ' LEU . 59.1 mtp -83.05 -39.12 21.63 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -176.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.505 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.63 -34.41 72.76 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.59 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.793 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.36 -23.61 54.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.484 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.8 mm-40 -77.81 -25.04 48.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.8 mp -85.37 -46.26 11.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.409 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.793 HG22 ' HA ' ' A' ' 88' ' ' GLN . 6.3 m -58.62 -32.33 45.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.38 -44.46 75.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 0.0 110.184 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.747 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.7 mp -68.76 -41.97 82.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.274 177.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 65.3 mt -56.98 -49.26 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 0.0 110.026 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -72.52 -36.36 68.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.276 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.44 -45.96 5.97 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.051 -172.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.539 ' SG ' HG23 ' A' ' 93' ' ' ILE . 83.5 m -70.74 -39.86 73.06 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.878 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.6 tm-20 -63.34 -38.23 90.36 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.222 0.465 . . . . 0.0 110.449 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -68.22 -36.04 78.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 110.939 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.3 m -96.69 7.79 45.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 111.272 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.19 144.6 84.82 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.1 -176.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 35.4 Cg_exo -61.14 146.12 97.95 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.347 2.032 . . . . 0.0 110.124 174.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 37.9 Cg_exo -57.07 91.14 0.05 OUTLIER 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.967 2.445 . . . . 0.0 113.256 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -125.97 93.47 3.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 175.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -81.3 63.45 5.63 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 0.0 110.927 -175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.775 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.3 t70 -124.18 112.36 16.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.213 172.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -34.09 -55.0 0.5 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.7 t -88.19 -30.55 19.66 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.032 0.833 . . . . 0.0 112.294 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.775 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 73.2 mmm -65.28 -36.25 83.5 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.659 ' HG3' ' H ' ' A' ' 111' ' ' THR . 5.6 ptpt -57.79 -48.39 79.83 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.818 0.818 . . . . 0.0 110.346 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.659 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -57.46 -10.66 1.52 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.602 174.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.766 HD12 ' HA3' ' A' ' 49' ' ' GLY . 1.1 mp -89.84 -41.36 13.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.754 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 4.4 m-20 -59.66 -35.49 74.53 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.362 174.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.629 HG21 ' HA ' ' A' ' 111' ' ' THR . 7.1 m -80.76 -35.49 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.046 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.408 ' N ' HG23 ' A' ' 114' ' ' VAL . . . -60.41 -51.57 68.92 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.337 0.589 . . . . 0.0 111.472 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.754 ' HE3' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -68.97 -25.17 64.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.251 179.538 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.5 t -68.57 -27.03 65.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.745 175.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.747 ' HB2' HG22 ' A' ' 93' ' ' ILE . 66.3 t80 -74.36 -44.31 52.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.285 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 1.2 pttp -70.49 -29.72 66.32 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.174 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.689 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.34 -56.18 23.01 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.958 0.409 . . . . 0.0 110.322 169.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -61.95 -42.28 98.93 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 175.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.1 -33.67 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 118.488 0.586 . . . . 0.0 111.078 175.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -71.59 -32.22 67.8 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.244 -0.285 . . . . 0.0 111.659 174.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.2 tttt -68.56 -35.84 77.95 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.317 0.58 . . . . 0.0 110.116 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.431 173.149 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo . . . . . 0 C--O 1.23 0.113 0 CA-C-O 121.061 0.359 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.46 -65.98 0.47 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.289 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.46 -15.2 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-O 121.126 0.489 . . . . 0.0 111.188 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.2 ttt -71.22 -24.94 62.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.91 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -100.33 94.08 6.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.908 174.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -64.12 138.93 58.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.278 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.7 -43.07 84.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.755 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.4 m -62.3 -36.56 82.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.98 -36.88 62.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.011 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.93 -55.82 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.956 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -48.97 -72.41 0.05 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.24 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.36 29.61 46.86 Favored Glycine 0 C--N 1.347 1.141 0 C-N-CA 121.039 -0.6 . . . . 0.0 113.772 -177.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -85.89 -37.26 19.32 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.14 0.47 . . . . 0.0 110.718 -178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.58 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.38 56.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.088 0.471 . . . . 0.0 111.314 -177.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.1 ttm -72.38 -38.48 68.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.155 0.502 . . . . 0.0 110.12 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.72 -34.43 74.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.905 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -90.42 -25.35 20.41 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.53 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 12.3 p -74.95 -33.0 61.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.89 ' HA ' HD23 ' A' ' 25' ' ' LEU . 9.9 tptm -57.11 -50.86 71.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.611 172.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -70.3 -42.65 71.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.44 -36.04 82.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.538 0.209 . . . . 0.0 111.339 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 50' ' ' CYS . 11.3 mt -81.03 -3.75 52.86 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.753 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.1 t 65.45 27.83 11.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.811 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.89 HD23 ' HA ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -55.01 119.86 25.34 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.012 176.506 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -75.01 156.86 42.98 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.774 2.316 . . . . 0.0 111.435 174.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.647 ' HA ' HG23 ' A' ' 30' ' ' VAL . 12.6 p-10 -66.73 -22.59 66.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.17 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 p -68.48 -39.76 81.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.0 110.761 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.56 HG11 ' OD2' ' A' ' 45' ' ' ASP . 93.1 t -70.35 -50.87 42.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.379 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.647 HG23 ' HA ' ' A' ' 27' ' ' ASP . 17.3 m -58.9 -33.6 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.393 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -50.45 67.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.499 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.43 -37.14 86.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.313 0.577 . . . . 0.0 110.01 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mt -57.91 -54.83 42.53 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.056 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -74.88 8.99 2.09 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -176.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -63.24 130.96 46.77 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.349 0.522 . . . . 0.0 110.771 -178.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -74.47 -31.68 62.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.142 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 -81.23 118.0 22.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.778 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.522 ' O ' ' HD3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -81.44 72.95 8.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.351 0.596 . . . . 0.0 111.754 -177.207 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.531 ' HB3' ' CD2' ' A' ' 41' ' ' TYR . 18.7 t70 -44.94 -44.64 9.94 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 173.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 20.6 m-20 75.01 70.9 0.09 Allowed 'General case' 0 C--N 1.35 0.607 0 CA-C-O 121.522 0.677 . . . . 0.0 110.489 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.531 ' CD2' ' HB3' ' A' ' 39' ' ' ASP . 9.1 p90 -117.73 176.68 5.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.455 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 44' ' ' THR . 6.2 t -92.16 121.06 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.68 ' HE2' HD11 ' A' ' 52' ' ' ILE . 41.6 ttm -62.25 100.93 0.19 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.519 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 42' ' ' VAL . 67.9 p -99.32 -23.64 15.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.56 ' OD2' HG11 ' A' ' 29' ' ' VAL . 10.3 t70 -83.82 134.21 34.72 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.5 0.667 . . . . 0.0 111.484 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.792 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 9.5 mpt_? -74.88 -21.87 58.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.465 -175.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.454 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.7 mm? -79.5 -13.04 59.83 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.445 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -61.69 1.89 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -41.07 -48.48 4.34 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 114.901 -1.045 . . . . 0.0 114.293 169.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.584 ' HB3' HD13 ' A' ' 23' ' ' LEU . 15.4 m -68.75 -38.86 80.42 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.49 1.145 . . . . 0.0 111.947 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.31 -23.97 67.49 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.68 HD11 ' HE2' ' A' ' 43' ' ' MET . 70.1 mt -61.96 -37.34 78.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 121.264 0.554 . . . . 0.0 110.622 177.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.459 ' N ' HD21 ' A' ' 53' ' ' ASN . 0.0 OUTLIER -132.88 85.47 2.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.803 0.811 . . . . 0.0 110.076 -178.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 24.4 p -119.01 -46.34 2.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.504 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.58 HD11 ' H ' ' A' ' 15' ' ' ALA . 1.5 tt -58.76 -67.07 0.4 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.041 0.448 . . . . 0.0 111.382 -171.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.547 ' HA ' HD11 ' A' ' 59' ' ' LEU . . . -82.04 -14.72 55.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 110.889 -173.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.459 HG21 HG11 ' A' ' 61' ' ' VAL . 1.4 m -83.04 -35.39 25.8 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.783 ' HZ3' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.56 -16.31 49.02 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.199 -0.601 . . . . 0.0 110.069 174.373 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.547 HD11 ' HA ' ' A' ' 56' ' ' ALA . 24.9 mt -64.63 -64.99 0.74 Allowed 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 121.164 -0.215 . . . . 0.0 111.206 172.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -174.61 126.2 0.31 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 -177.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.478 ' CG2' ' HA ' ' A' ' 73' ' ' ALA . 14.6 p 179.89 38.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 122.348 1.07 . . . . 0.0 109.193 -173.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.683 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 25.2 m -105.17 118.56 52.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.198 -172.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -69.37 -56.01 8.96 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.534 175.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.702 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.3 Cg_endo -98.28 -142.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 123.537 2.825 . . . . 0.0 113.524 -172.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.405 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -72.13 -2.98 20.6 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.866 -174.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.58 -66.22 0.46 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -174.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.702 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.1 p-10 -71.37 153.73 42.1 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.683 -0.759 . . . . 0.0 110.842 178.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.416 ' HB2' HD21 ' A' ' 67' ' ' ASN . 0.1 OUTLIER 68.47 32.92 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.567 169.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.683 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.7 p80 -74.61 69.18 1.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.864 0.84 . . . . 0.0 110.841 175.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.507 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 64.2 t60 -86.95 -60.79 1.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.858 -176.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.52 -53.45 45.85 Favored Glycine 0 N--CA 1.461 0.365 0 C-N-CA 121.223 -0.513 . . . . 0.0 113.096 -175.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -56.05 -34.05 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.633 0.254 . . . . 0.0 111.484 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.478 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -74.61 -33.95 62.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.146 0.498 . . . . 0.0 110.744 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.628 ' O ' ' HG3' ' A' ' 78' ' ' MET . 23.2 mmmt -79.04 -35.32 42.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.35 -40.2 95.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.004 174.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -59.7 -36.74 77.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.531 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -36.25 75.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.901 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.628 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 50.8 mtt -67.78 -33.35 74.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.958 0.409 . . . . 0.0 110.782 -177.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -91.27 -10.54 41.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.026 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -145.72 94.4 2.49 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.541 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.4 -60.92 0.41 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.065 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.3 147.28 26.14 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.133 -0.534 . . . . 0.0 110.474 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.572 ' HB2' ' HB3' ' A' ' 86' ' ' MET . 3.6 m-20 -75.72 146.92 39.74 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 173.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.801 ' HG3' HE21 ' A' ' 88' ' ' GLN . 0.2 OUTLIER -67.53 -47.29 70.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.15 -39.67 44.17 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.87 169.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.572 ' HB3' ' HB2' ' A' ' 83' ' ' ASP . 0.8 OUTLIER -82.82 -37.88 23.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -173.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.541 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -60.79 -41.03 94.8 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.993 174.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.801 HE21 ' HG3' ' A' ' 84' ' ' GLU . 2.6 mp0 -71.29 -27.21 63.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.653 -173.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.405 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -84.77 -22.07 29.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.742 173.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.7 tt -86.12 -42.53 13.81 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.06 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.497 HG11 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -58.76 -32.98 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 122.944 0.498 . . . . 0.0 111.948 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.73 -42.29 97.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.015 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.562 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -62.59 -41.49 92.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.012 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 34.2 mt -56.94 -47.65 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.385 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -67.62 -35.98 79.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.293 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.2 -46.65 5.8 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.183 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.717 ' HB2' HG12 ' A' ' 114' ' ' VAL . 43.7 m -73.4 -35.2 65.82 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.783 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 6.1 mt-10 -66.12 -37.24 85.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.864 0.756 . . . . 0.0 111.029 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -64.02 -42.24 97.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.869 0.366 . . . . 0.0 110.473 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.9 m -100.36 22.62 11.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.208 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.6 156.81 70.47 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.063 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.411 ' C ' ' H ' ' A' ' 104' ' ' ASN . 94.6 Cg_exo -44.41 141.4 5.22 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.892 2.395 . . . . 0.0 111.819 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.02 22.97 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.872 2.381 . . . . 0.0 113.666 -171.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.411 ' H ' ' C ' ' A' ' 102' ' ' PRO . 3.5 m-20 -115.21 94.14 4.6 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -74.31 97.7 3.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.194 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.526 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 8.7 t70 -89.3 115.52 26.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.854 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -29.72 -63.35 0.13 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.18 1.55 . . . . 0.0 113.627 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 9.9 t -96.89 -12.84 22.96 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -175.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.792 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 3.1 mmm -86.75 -26.18 24.32 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -170.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.679 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -54.36 -44.89 72.58 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.076 0.941 . . . . 0.0 110.852 -171.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.679 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 14.8 t -57.84 -13.2 3.92 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.806 -1.543 . . . . 0.0 113.092 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -91.17 -37.97 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.48 -38.27 77.26 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.79 175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.717 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -78.95 -36.28 18.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 121.283 0.563 . . . . 0.0 110.265 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.47 -46.83 88.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.645 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.635 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 21.9 ptt? -69.57 -17.61 63.57 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.628 176.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.63 -30.1 64.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.756 0.788 . . . . 0.0 109.071 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -82.06 -39.77 22.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.669 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.939 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.6 -24.27 63.64 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 118.833 -1.147 . . . . 0.0 110.279 177.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.16 -54.99 27.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.991 160.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.54 -49.61 76.78 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 178.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.939 HG23 ' HA ' ' A' ' 119' ' ' LYS . 8.7 tt -57.77 -34.44 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 122.009 -0.432 . . . . 0.0 110.961 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.601 ' N ' HG22 ' A' ' 122' ' ' ILE . 4.6 m-70 -70.45 -29.5 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 177.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -63.04 -34.5 77.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.3 mt . . . . . 0 CA--C 1.54 0.575 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.182 173.905 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo . . . . . 0 N--CA 1.473 0.322 0 CA-C-O 121.009 0.337 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.62 -69.19 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.624 179.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -77.83 -10.7 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.075 0.464 . . . . 0.0 111.215 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.833 ' HE2' ' HA ' ' A' ' 5' ' ' MET . 2.6 tpt -65.33 -39.72 92.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.119 0.485 . . . . 0.0 110.065 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -82.41 103.48 12.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.743 174.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -63.74 148.43 49.18 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.46 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.459 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 9.7 mp -58.92 -52.65 64.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.088 -176.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.9 m -63.3 -33.28 75.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.738 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -72.43 -37.27 68.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.556 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.35 -54.73 13.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.853 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 24.8 m-85 -44.73 -69.11 0.15 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.646 171.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.73 33.93 63.91 Favored Glycine 0 C--N 1.342 0.899 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.05 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -67.46 -53.6 27.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 117.598 0.699 . . . . 0.0 109.537 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 18' ' ' GLN . . . -144.79 88.17 1.89 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.106 0.479 . . . . 0.0 111.09 176.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.0 ttm -69.97 -35.53 74.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.09 -36.55 84.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.548 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 15' ' ' ALA . 34.2 mt-30 -89.47 -25.27 21.55 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.687 -0.805 . . . . 0.0 111.452 -172.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -68.83 -35.69 77.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 170.051 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.908 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -61.55 -46.81 88.35 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.922 175.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -69.79 -43.62 71.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.867 -176.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -70.58 -33.61 71.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -174.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.645 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 7.0 mt -86.97 -4.5 59.18 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.434 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m 59.09 43.42 17.46 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.359 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.908 HD22 ' HA ' ' A' ' 20' ' ' LYS . 4.3 mm? -49.77 120.62 11.37 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.9 174.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.625 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 12.3 Cg_exo -72.67 154.4 54.49 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 121.941 1.761 . . . . 0.0 110.814 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.67 ' HA ' HG23 ' A' ' 30' ' ' VAL . 15.0 p-10 -64.13 -27.36 69.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.826 -176.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 m -65.93 -36.26 82.87 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.122 0.487 . . . . 0.0 110.381 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.9 t -82.35 -41.04 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.476 -176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.67 HG23 ' HA ' ' A' ' 27' ' ' ASP . 27.4 m -58.87 -33.19 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.838 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.98 -51.95 53.86 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.539 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.9 -37.2 86.52 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.7 tp -51.48 -51.74 52.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.63 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -67.84 11.56 0.14 Allowed 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.54 HD21 ' HB3' ' A' ' 39' ' ' ASP . 27.5 p-10 -59.67 111.11 1.31 Allowed 'General case' 0 C--N 1.346 0.429 0 CA-C-N 120.522 1.51 . . . . 0.0 111.382 -174.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -95.46 -2.66 48.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.925 0.393 . . . . 0.0 111.249 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 p90 -91.14 160.51 15.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.139 177.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.807 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -73.26 80.23 1.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 122.074 0.94 . . . . 0.0 110.619 176.614 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.54 ' HB3' HD21 ' A' ' 35' ' ' ASN . 4.7 p-10 -44.82 -53.33 7.58 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.9 p30 49.02 33.06 4.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.595 0.758 . . . . 0.0 111.147 -169.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.56 177.37 4.87 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.69 -176.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.429 HG12 ' HE2' ' A' ' 119' ' ' LYS . 22.4 t -101.71 136.11 35.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.898 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.671 ' HE2' HG13 ' A' ' 112' ' ' ILE . 51.8 ttp -70.75 101.46 2.1 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -97.72 -40.82 8.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.257 -173.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' HB2' ' A' ' 47' ' ' LEU . 8.5 t70 -86.44 120.17 27.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.355 0.598 . . . . 0.0 112.052 -173.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.699 ' HG2' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -44.21 -42.28 6.4 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 114.493 -1.23 . . . . 0.0 113.155 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.699 HD22 ' HG2' ' A' ' 46' ' ' ARG . 3.7 mm? -64.67 -19.47 65.75 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 122.262 -0.274 . . . . 0.0 111.45 -175.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.08 -59.79 2.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -178.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.54 -47.46 2.95 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-N 115.097 -0.956 . . . . 0.0 114.467 166.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.402 ' HB3' HD13 ' A' ' 23' ' ' LEU . 30.0 m -63.41 -43.76 96.6 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.489 1.144 . . . . 0.0 111.22 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.52 -23.79 66.29 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.523 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.0 mm -63.86 -34.24 66.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.108 0.48 . . . . 0.0 110.594 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -140.1 63.18 1.48 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.187 0.518 . . . . 0.0 111.277 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.427 ' CB ' HD12 ' A' ' 23' ' ' LEU . 28.7 p -114.54 -38.65 3.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 177.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.575 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.3 tt -62.72 -55.63 24.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.551 -170.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.1 -13.69 58.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.079 0.466 . . . . 0.0 110.42 -173.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.566 HG21 ' CG1' ' A' ' 61' ' ' VAL . 36.7 m -82.97 -35.89 25.56 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.54 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.755 ' HZ3' ' HB3' ' A' ' 58' ' ' LYS . 9.0 mtpm? -81.53 -16.03 53.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.265 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.2 mt -65.62 -65.32 0.69 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.255 170.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -175.7 121.31 0.19 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.706 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.566 ' CG1' HG21 ' A' ' 57' ' ' THR . 11.5 p -177.28 36.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.477 1.132 . . . . 0.0 109.12 -178.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.586 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.2 m -103.88 117.52 49.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.42 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -54.41 7.54 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.956 177.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.682 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -96.41 -145.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.911 2.407 . . . . 0.0 112.906 -173.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.403 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.1 m-20 -76.71 10.14 2.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.376 -176.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.72 -69.56 0.52 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.682 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.3 p-10 -69.12 149.42 48.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.712 -0.744 . . . . 0.0 111.36 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.58 HD23 HD21 ' A' ' 67' ' ' ASN . 4.0 mm? 69.7 31.69 3.5 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 16.5 p-80 -74.74 68.86 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.314 0.578 . . . . 0.0 110.878 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -86.39 -49.02 7.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.926 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.15 -53.7 43.54 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.582 -174.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -62.01 -27.67 69.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -36.64 73.22 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.672 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 32.1 mmmt -80.03 -35.65 36.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.74 -37.58 88.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.402 173.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -63.07 -35.96 81.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.172 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.23 -37.05 74.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.61 ' HE3' ' HG2' ' A' ' 84' ' ' GLU . 81.0 mtp -74.44 -39.01 62.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.358 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -82.98 -12.34 57.38 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.804 0.335 . . . . 0.0 110.292 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -144.4 94.56 2.58 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.342 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.83 -64.94 0.47 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.046 -1.073 . . . . 0.0 113.428 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.23 138.34 41.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.032 0.444 . . . . 0.0 111.833 -175.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.597 ' OD2' HG21 ' A' ' 85' ' ' THR . 1.0 OUTLIER -84.05 174.46 10.27 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 172.246 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.61 ' HG2' ' HE3' ' A' ' 78' ' ' MET . 30.1 mt-10 -62.22 -35.38 78.72 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.47 -167.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.801 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 12.7 t -61.76 -38.37 87.75 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.751 -177.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 65.4 mtm -81.32 -39.38 25.24 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -174.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.58 -39.74 89.17 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.279 173.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.8 mp0 -73.73 -26.4 60.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.709 -177.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.801 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.7 mm-40 -78.46 -23.56 46.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.619 177.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.642 ' O ' HG13 ' A' ' 94' ' ' ILE . 3.4 mm? -85.26 -49.04 8.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.961 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 19.9 m -57.99 -39.39 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.14 -43.06 71.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.869 0.366 . . . . 0.0 110.536 -176.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.701 HG23 ' SG ' ' A' ' 97' ' ' CYS . 3.2 mm -63.43 -42.12 95.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.335 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.8 mt -51.55 -47.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.622 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.1 m170 -70.87 -36.46 72.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.166 0.508 . . . . 0.0 110.639 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.55 -49.5 4.6 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.334 -172.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.72 ' HB2' HG12 ' A' ' 114' ' ' VAL . 57.9 m -71.39 -35.76 71.16 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.867 -177.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 1.3 mt-10 -63.92 -37.73 88.48 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.603 0.638 . . . . 0.0 110.88 172.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.22 -35.87 82.21 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.041 0.448 . . . . 0.0 110.546 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.5 m -107.43 25.51 11.36 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.472 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -87.32 149.64 47.41 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -175.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.16 149.24 81.6 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.364 2.043 . . . . 0.0 110.288 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -66.45 71.87 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.857 2.372 . . . . 0.0 113.146 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -99.73 91.66 4.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -81.2 77.27 8.11 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.962 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.717 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.7 t70 -145.3 128.43 16.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.733 174.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HE2' ' HB3' ' A' ' 107' ' ' LYS . 13.4 ttpt -29.25 -55.87 0.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 125.024 1.453 . . . . 0.0 114.508 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.43 ' CB ' ' HB2' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -93.72 -16.97 23.69 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.519 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.717 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 90.3 mmm -74.3 -32.14 62.76 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 121.841 -0.537 . . . . 0.0 111.731 -172.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.763 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -62.71 -49.53 74.71 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.692 0.758 . . . . 0.0 109.853 178.013 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.763 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.06 -14.21 6.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.468 175.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.671 HG13 ' HE2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -89.27 -39.71 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.493 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 12.2 t70 -62.94 -35.38 79.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.484 177.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.72 HG12 ' HB2' ' A' ' 97' ' ' CYS . 15.8 m -79.42 -38.15 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.025 0.441 . . . . 0.0 110.168 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -60.44 -49.1 78.92 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-O 121.544 0.688 . . . . 0.0 111.304 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 25.0 ptt? -69.58 -19.85 63.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.06 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.841 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 8.5 t -72.79 -24.17 60.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.455 ' HE1' ' HB3' ' A' ' 89' ' ' GLN . 57.6 t80 -77.76 -40.58 40.41 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.424 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.767 ' HA ' HG23 ' A' ' 122' ' ' ILE . 2.2 pttp -67.82 -29.62 68.82 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 118.725 -1.19 . . . . 0.0 110.348 176.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.841 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.99 -54.62 44.89 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.625 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.412 ' HG3' HD13 ' A' ' 93' ' ' ILE . 14.4 mm-40 -58.71 -52.03 67.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.844 176.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.767 HG23 ' HA ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -54.91 -36.63 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.463 ' N ' HG22 ' A' ' 122' ' ' ILE . 57.7 m170 -70.86 -32.15 69.07 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.302 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -71.18 -33.94 70.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.214 0.53 . . . . 0.0 110.393 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.546 173.782 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 CA--C 1.531 0.354 0 CA-C-O 120.653 0.189 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -51.1 -70.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.784 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.631 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -78.98 -9.48 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 121.149 0.499 . . . . 0.0 111.183 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 26.0 ttt -71.48 -30.09 65.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.33 -178.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.648 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 1.8 tpmt? -89.28 103.84 16.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.768 176.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.554 ' HB2' ' HB3' ' A' ' 10' ' ' ASN . 6.3 m120 -84.85 127.57 34.21 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.745 HD22 ' HB3' ' A' ' 80' ' ' HIS . 7.3 mp -60.13 -52.99 63.0 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -176.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -64.57 -26.83 68.58 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.447 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.554 ' HB3' ' HB2' ' A' ' 7' ' ' ASN . 27.9 t-20 -75.62 -34.31 60.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.494 177.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -74.5 -55.4 5.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.943 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -50.08 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.94 45.28 81.5 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 120.669 -0.777 . . . . 0.0 113.051 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.53 -60.24 3.95 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.829 0.347 . . . . 0.0 110.988 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -150.5 93.76 2.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.54 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 ttp -74.07 -31.01 62.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.68 -30.42 63.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.252 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -88.06 -26.21 22.66 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.037 -175.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 82.8 m -75.71 -31.04 59.49 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 170.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 1.0 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 23.4 tptp -56.18 -50.11 72.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.327 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.775 -178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.511 ' CD ' ' HZ1' ' A' ' 58' ' ' LYS . 22.4 tt0 -69.74 -37.29 76.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -173.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.983 ' HB2' HD11 ' A' ' 25' ' ' LEU . 16.0 mt -86.22 -6.28 59.01 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.132 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.7 t 59.53 43.82 15.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.435 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 1.0 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 10.3 mp -50.14 124.87 18.14 Favored Pre-proline 0 N--CA 1.47 0.559 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.313 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.545 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 11.1 Cg_exo -71.86 151.26 56.73 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.256 1.971 . . . . 0.0 110.072 170.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.529 ' HA ' HG23 ' A' ' 30' ' ' VAL . 1.5 p30 -66.29 -26.01 67.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.847 0.356 . . . . 0.0 111.218 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 p -65.76 -32.91 74.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.07 0.462 . . . . 0.0 110.7 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.498 HG11 ' HB2' ' A' ' 47' ' ' LEU . 23.8 t -79.04 -42.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.37 -177.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 27' ' ' ASP . 34.8 m -59.61 -29.22 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.126 0.489 . . . . 0.0 109.745 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.65 -52.71 41.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.6 176.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.97 -36.31 81.91 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.323 0.583 . . . . 0.0 109.747 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.8 tp -47.09 -55.67 7.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.253 173.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -66.58 10.07 0.14 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -65.78 116.18 6.7 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 120.393 1.451 . . . . 0.0 109.895 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -78.26 -28.79 47.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.289 -176.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -82.66 98.08 8.85 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -174.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -91.35 67.5 5.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.984 -174.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -63.47 13.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.06 70.47 0.65 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 119.087 0.858 . . . . 0.0 110.096 -169.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -103.05 171.07 7.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.574 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.8 t -90.67 113.56 26.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.211 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.547 ' O ' HG22 ' A' ' 112' ' ' ILE . 40.4 ttm -79.25 95.5 5.67 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.809 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.1 p -93.22 -18.0 23.03 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -84.88 133.81 34.3 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.811 0.815 . . . . 0.0 110.517 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.509 ' HE ' ' CG ' ' A' ' 106' ' ' ASP . 9.9 mpt_? -68.98 -31.49 70.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.084 -1.416 . . . . 0.0 109.769 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.545 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.4 mm? -75.11 -14.88 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.04 -58.29 2.75 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.443 ' O ' HG22 ' A' ' 52' ' ' ILE . . . -38.64 -45.01 1.91 Allowed Glycine 0 CA--C 1.534 1.261 0 CA-C-N 114.919 -1.037 . . . . 0.0 114.655 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.466 ' HB3' HD12 ' A' ' 23' ' ' LEU . 4.1 m -76.24 -44.92 35.27 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.473 1.136 . . . . 0.0 112.247 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.4 -23.87 63.78 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 49' ' ' GLY . 14.7 tt -71.72 -19.86 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 0.0 110.945 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -144.08 85.24 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.229 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 23.9 t -121.76 -45.24 2.29 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.55 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.25 -49.07 78.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.97 0.414 . . . . 0.0 111.51 -174.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.53 -15.67 51.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.962 0.41 . . . . 0.0 110.921 -174.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.508 HG21 HG12 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -83.78 -34.63 24.72 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.396 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.511 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 43.2 mtpt -82.92 -12.92 56.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.199 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.27 -64.09 0.95 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.888 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -175.05 111.7 0.13 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.508 HG12 HG21 ' A' ' 57' ' ' THR . 8.1 p -176.0 32.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-O 121.327 0.584 . . . . 0.0 111.497 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.58 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.8 m -109.65 117.58 54.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.28 -0.888 . . . . 0.0 111.659 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.574 ' HB2' ' HA ' ' A' ' 69' ' ' HIS . 0.1 OUTLIER -65.73 -59.68 8.75 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.485 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 27.6 Cg_endo -104.87 -139.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.52 2.813 . . . . 0.0 112.607 -171.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.508 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -72.13 -0.3 11.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.153 -177.652 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.78 -75.7 0.27 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.995 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.7 p-10 -70.06 152.68 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.084 -0.558 . . . . 0.0 111.637 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.49 HD23 HD21 ' A' ' 67' ' ' ASN . 4.6 mm? 70.98 27.67 3.34 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.504 0.722 . . . . 0.0 112.325 174.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.58 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 4.4 p80 -74.65 68.12 1.62 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 111.119 171.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -87.49 -31.66 19.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.395 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.6 -63.33 3.77 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.953 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.575 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 7.9 m-80 -55.26 -25.43 33.66 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 122.913 0.485 . . . . 0.0 112.087 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.27 -38.09 75.01 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.38 0.61 . . . . 0.0 110.291 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.49 ' HE3' HD13 ' A' ' 94' ' ' ILE . 59.9 mmtt -81.5 -36.43 29.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.762 177.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.575 ' HB3' ' HA ' ' A' ' 72' ' ' ASN . 11.2 t70 -60.58 -40.67 92.58 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.361 174.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -60.83 -42.41 97.69 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.443 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.39 -30.25 68.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.434 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 84.7 mtp -74.23 -40.88 62.12 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.598 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 13.6 ptpt -94.28 -7.89 40.65 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.456 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.745 ' HB3' HD22 ' A' ' 8' ' ' LEU . 42.5 m-70 -139.91 90.82 2.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.36 176.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.38 -75.74 0.42 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.646 173.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.631 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -96.91 149.8 21.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.513 ' OD2' HG21 ' A' ' 85' ' ' THR . 0.2 OUTLIER -84.37 169.4 14.65 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 173.092 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -67.05 -38.22 85.46 Favored 'General case' 0 N--CA 1.411 -2.405 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.148 -168.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.75 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.7 OUTLIER -62.21 -33.51 74.69 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.08 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 7.4 tpt -84.56 -39.98 18.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -57.98 -38.97 77.05 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.535 172.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -71.67 -23.83 61.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.197 -178.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.75 ' HG2' ' O ' ' A' ' 85' ' ' THR . 9.0 mm-40 -77.21 -25.75 52.05 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.478 ' HG ' HD12 ' A' ' 94' ' ' ILE . 22.1 tp -86.95 -44.91 11.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.274 -175.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.431 HG12 ' O ' ' A' ' 87' ' ' ALA . 26.7 m -57.36 -34.46 46.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.281 -175.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.69 -44.07 78.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.776 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -65.46 -41.06 90.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.854 175.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.49 HD13 ' HE3' ' A' ' 74' ' ' LYS . 86.4 mt -55.45 -48.24 77.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.681 -177.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -72.28 -35.26 68.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.897 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.9 -43.71 7.52 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.879 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.63 ' SG ' HG23 ' A' ' 93' ' ' ILE . 63.0 m -72.79 -34.54 66.98 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 121.398 -0.121 . . . . 0.0 110.789 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.562 ' N ' HG13 ' A' ' 114' ' ' VAL . 36.9 tt0 -57.41 -38.38 74.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.819 0.343 . . . . 0.0 110.732 170.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -64.77 -43.23 93.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.168 175.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.1 m -99.0 25.17 6.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.841 0.353 . . . . 0.0 111.745 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 102' ' ' PRO . . . -76.09 148.21 81.04 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.606 178.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 23.9 Cg_exo -64.42 151.38 85.73 Favored 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.672 2.248 . . . . 0.0 111.871 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.4 Cg_exo -70.55 59.3 2.01 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -121.61 116.72 25.13 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -81.12 93.17 6.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.919 0.39 . . . . 0.0 111.249 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.698 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 6.2 m-20 -130.03 97.65 4.53 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.318 0.58 . . . . 0.0 110.152 170.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.487 ' HE3' ' HB3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -42.65 -49.05 5.58 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 176.321 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.06 -24.14 28.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.871 1.214 . . . . 0.0 112.16 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.698 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 2.4 mmm -85.54 -26.72 26.02 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.534 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.1 OUTLIER -56.78 -45.95 81.8 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.737 0.779 . . . . 0.0 111.311 -170.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.534 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.93 -14.06 5.62 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.288 177.363 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.547 HG22 ' O ' ' A' ' 43' ' ' MET . 3.7 mp -90.13 -37.14 9.21 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 176.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -60.09 -35.31 74.93 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.518 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.562 HG13 ' N ' ' A' ' 98' ' ' GLU . 16.5 m -81.26 -34.97 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.79 84.44 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.243 0.544 . . . . 0.0 111.653 174.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.548 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.523 179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 43.2 t -73.02 -23.12 60.57 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.863 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.776 ' HB2' HG22 ' A' ' 93' ' ' ILE . 34.8 t80 -79.76 -46.56 16.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.534 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.17 -25.21 64.24 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 118.499 -1.28 . . . . 0.0 109.345 177.6 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.548 ' HE3' ' O ' ' A' ' 116' ' ' MET . 3.5 ttmt -54.02 -55.69 24.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.166 169.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.446 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 27.4 mm-40 -59.11 -40.52 85.62 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.509 173.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.55 HD13 HD11 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -57.23 -35.23 47.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 118.467 0.576 . . . . 0.0 111.349 176.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -72.46 -31.67 65.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.115 0.484 . . . . 0.0 111.135 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -71.0 -22.35 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.556 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.55 HD11 HD13 ' A' ' 122' ' ' ILE . 96.6 mt . . . . . 0 CA--C 1.534 0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.727 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.3 Cg_exo . . . . . 0 C--O 1.224 -0.19 0 CA-C-O 120.649 0.187 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -49.25 -68.25 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.823 177.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.8 tp -78.15 -14.3 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.115 0.483 . . . . 0.0 111.447 -177.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.412 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.7 mmm -80.15 -21.43 43.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.5 tttp -90.56 114.11 26.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -88.99 135.04 33.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.457 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.835 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.7 mp -58.03 -48.15 80.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.173 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.5 m -60.83 -37.02 80.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.004 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -70.54 -37.22 74.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.841 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -72.09 -56.75 5.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.406 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -58.7 -79.94 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.95 42.08 69.49 Favored Glycine 0 C--N 1.344 0.99 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.726 -171.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -81.9 -36.98 27.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.211 0.529 . . . . 0.0 110.528 -176.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.06 55.74 1.38 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.574 0.702 . . . . 0.0 109.638 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.43 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 53.9 tpp -69.77 -37.71 76.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.709 -177.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -54.09 -38.07 64.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.594 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 30.2 mt-30 -90.67 -27.24 19.14 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.346 -0.542 . . . . 0.0 111.67 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 9.1 p -76.83 -33.04 57.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.743 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 8.9 tptp -57.91 -49.69 75.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.75 172.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.91 -39.94 72.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.393 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 3.2 tm-20 -68.57 -39.27 81.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.201 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -77.37 -4.71 46.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.122 0.487 . . . . 0.0 110.385 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.2 m 65.43 36.3 6.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.504 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.743 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 18.2 mt -65.07 120.09 64.18 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.786 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.562 ' CD ' HD23 ' A' ' 47' ' ' LEU . 7.9 Cg_exo -73.95 163.41 36.96 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.838 2.359 . . . . 0.0 110.444 171.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -62.34 -32.32 73.07 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.408 -174.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -63.95 -52.9 57.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 111.447 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.717 HG22 HD21 ' A' ' 47' ' ' LEU . 59.1 t -70.14 -53.38 23.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.75 -175.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 9.9 p -59.9 -30.01 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.007 -176.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.84 -51.48 40.04 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.05 -34.58 78.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.661 0.743 . . . . 0.0 109.388 178.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -53.82 -38.73 64.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.612 171.214 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.441 ' CE2' HG21 ' A' ' 30' ' ' VAL . 19.6 m-85 -76.28 9.13 2.76 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -65.4 108.01 1.83 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.915 0.78 . . . . 0.0 109.89 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -71.27 -33.57 69.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.732 -175.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 25.9 m-90 -74.13 126.84 31.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.468 0.652 . . . . 0.0 110.294 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.742 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -75.99 69.9 2.64 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.808 -178.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.629 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 29.1 t70 -43.62 -23.96 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 176.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.1 t0 67.32 71.4 0.36 Allowed 'General case' 0 C--N 1.351 0.637 0 CA-C-N 118.97 0.804 . . . . 0.0 109.553 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.629 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.2 p90 -124.19 169.84 11.33 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.758 -177.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -90.21 132.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 35.9 ttp -68.95 93.19 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.477 0.656 . . . . 0.0 109.621 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.9 p -88.33 -40.65 13.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.737 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.659 ' OD2' HG11 ' A' ' 29' ' ' VAL . 24.1 t70 -80.96 117.74 21.84 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 122.246 1.022 . . . . 0.0 111.059 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.697 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.33 -37.39 62.27 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.066 -1.879 . . . . 0.0 111.792 172.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.717 HD21 HG22 ' A' ' 29' ' ' VAL . 28.3 tp -71.27 -18.06 62.44 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 -173.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.406 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -51.87 8.13 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.95 -46.03 1.7 Allowed Glycine 0 CA--C 1.531 1.073 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.212 165.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.9 m -68.87 -43.42 75.39 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.393 1.097 . . . . 0.0 109.596 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.58 -9.47 58.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.354 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 48' ' ' ALA . 55.9 mt -59.22 -36.17 61.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.05 0.452 . . . . 0.0 110.282 175.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -135.47 84.77 2.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.569 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.3 p -102.26 -45.51 5.1 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.9 -178.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.45 ' O ' HD23 ' A' ' 59' ' ' LEU . 61.9 tp -60.64 -57.02 14.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.267 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.22 -15.69 54.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.009 0.433 . . . . 0.0 110.762 -170.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.618 HG21 HG12 ' A' ' 61' ' ' VAL . 96.0 m -74.79 -34.0 62.35 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.556 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 14.8 mmmt -79.36 -25.85 42.16 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.435 177.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.45 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.1 mm? -65.42 -64.29 0.9 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.846 172.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -176.27 117.17 0.13 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.691 0.282 . . . . 0.0 110.776 -175.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.618 HG12 HG21 ' A' ' 57' ' ' THR . 11.2 p -166.43 32.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.239 1.019 . . . . 0.0 109.338 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.704 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 35.5 m -111.28 120.68 62.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.176 -174.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.19 -56.15 2.04 Favored Pre-proline 0 CA--C 1.533 0.318 0 O-C-N 122.277 -0.264 . . . . 0.0 111.43 175.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.663 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 10.9 Cg_endo -97.04 -146.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.155 2.57 . . . . 0.0 112.682 -173.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.477 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -74.56 11.76 0.94 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.788 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.77 -68.88 0.54 Allowed Glycine 0 C--N 1.317 -0.49 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.316 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.769 HD21 HD23 ' A' ' 68' ' ' LEU . 3.6 p-10 -70.0 149.5 47.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.43 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.769 HD23 HD21 ' A' ' 67' ' ' ASN . 4.0 mm? 68.69 31.73 4.45 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 173.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.704 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 13.3 p80 -73.9 72.6 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.583 0.706 . . . . 0.0 111.669 176.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -87.34 -47.52 8.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.044 -179.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.63 -59.07 11.51 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.89 -173.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -63.28 -24.18 67.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.29 -36.51 68.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.221 0.534 . . . . 0.0 110.378 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HE3' HG12 ' A' ' 91' ' ' VAL . 3.1 mmmp? -79.91 -33.37 39.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.891 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.634 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 20.9 t70 -64.23 -42.1 96.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.084 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -63.89 -39.52 94.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.82 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.7 -33.7 72.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.164 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.429 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 68.7 mtm -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.961 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 3.7 ptpp? -93.16 -14.16 27.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.867 -0.733 . . . . 0.0 111.583 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.835 ' HB3' HD21 ' A' ' 8' ' ' LEU . 47.5 m-70 -139.08 92.64 2.61 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.403 178.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.27 -75.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.579 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.22 146.22 30.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.579 0.228 . . . . 0.0 110.559 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.692 ' OD1' HG21 ' A' ' 85' ' ' THR . 2.5 p30 -87.54 174.71 8.31 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.343 0.592 . . . . 0.0 110.643 173.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -49.46 69.95 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.56 -166.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.75 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.1 t -62.76 -32.27 73.39 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.465 -175.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 72.0 mtp -79.59 -39.46 31.65 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.447 0.641 . . . . 0.0 109.53 -173.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.534 ' HB3' ' HZ3' ' A' ' 74' ' ' LYS . . . -63.14 -31.64 72.84 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.507 176.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.871 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -82.35 -19.61 38.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.8 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.75 ' HG2' ' O ' ' A' ' 85' ' ' THR . 75.4 mm-40 -78.58 -23.68 45.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.624 ' O ' HG13 ' A' ' 94' ' ' ILE . 24.9 tp -85.98 -43.86 12.82 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.006 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.871 HG22 ' HA ' ' A' ' 88' ' ' GLN . 2.8 m -57.67 -29.73 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -175.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -68.08 -43.02 79.51 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.265 0.555 . . . . 0.0 109.865 -178.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.579 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.01 -42.05 85.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.058 175.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.624 HG13 ' O ' ' A' ' 90' ' ' LEU . 27.2 mt -54.95 -47.59 76.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 CA-C-O 120.921 0.391 . . . . 0.0 110.174 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -70.22 -37.07 74.95 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.826 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.94 -48.39 5.2 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.277 -173.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.759 ' HB2' HG12 ' A' ' 114' ' ' VAL . 39.7 m -72.98 -37.42 67.05 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -67.36 -37.36 83.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 117.969 0.349 . . . . 0.0 110.494 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.34 -33.4 75.77 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.814 0.34 . . . . 0.0 110.577 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.7 m -97.73 8.11 45.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.324 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.24 155.51 79.44 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.885 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.487 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 59.6 Cg_exo -52.88 138.21 60.85 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.75 2.3 . . . . 0.0 111.977 176.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.7 Cg_exo -71.28 35.1 0.27 Allowed 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.592 2.861 . . . . 0.0 113.208 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 102' ' ' PRO . 52.5 t30 -95.94 119.47 34.49 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.97 96.03 4.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.435 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.937 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.5 t70 -144.38 119.03 9.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.346 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HZ3' ' HB2' ' A' ' 107' ' ' LYS . 4.0 ttmp? -29.92 -71.83 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.074 1.484 . . . . 0.0 113.776 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.498 ' O ' HD11 ' A' ' 112' ' ' ILE . 81.6 m -88.79 -14.72 36.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -174.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.937 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -63.12 -42.62 99.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.703 0.683 . . . . 0.0 110.453 -178.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.724 ' HG3' ' H ' ' A' ' 111' ' ' THR . 0.6 OUTLIER -64.44 -49.97 69.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.651 0.738 . . . . 0.0 110.422 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.724 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -59.04 -13.4 6.6 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.913 175.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -88.3 -35.86 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.778 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 0.2 OUTLIER -59.81 -37.56 79.5 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.046 173.254 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.759 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.7 m -78.02 -38.29 24.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.733 178.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.07 -52.59 64.71 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 121.006 0.432 . . . . 0.0 111.739 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.778 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -69.4 -24.68 63.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.58 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.887 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 13.8 t -69.09 -25.43 64.42 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.594 0.712 . . . . 0.0 110.142 176.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.573 ' HA ' HG12 ' A' ' 93' ' ' ILE . 75.1 t80 -79.81 -43.09 23.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.133 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.421 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.6 pttp -68.12 -28.1 67.04 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.736 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.887 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.42 -54.95 41.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.709 0.29 . . . . 0.0 111.008 173.211 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.556 ' HG3' ' N ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -59.52 -47.59 84.94 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.346 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.556 ' N ' ' HG3' ' A' ' 121' ' ' GLU . 1.9 tt -59.85 -31.24 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 120.932 0.396 . . . . 0.0 110.943 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -70.6 -30.86 67.65 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 176.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -36.15 69.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.407 174.345 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 N--CA 1.466 -0.132 0 CA-C-O 120.709 0.212 . . . . 0.0 111.738 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -49.93 -69.56 0.11 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.934 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -78.19 -12.94 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.05 0.453 . . . . 0.0 111.495 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 74.5 mmm -79.5 -21.83 44.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 110.958 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -89.11 103.84 16.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.967 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -62.44 136.17 57.78 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.916 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.627 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.5 pt? -56.4 -42.96 78.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.843 178.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.756 ' HB3' HD13 ' A' ' 55' ' ' LEU . 50.8 m -61.44 -30.28 70.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -74.7 -31.66 61.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.083 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -75.6 -49.36 18.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.145 176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -46.7 -74.2 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 172.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.3 46.04 87.35 Favored Glycine 0 C--N 1.34 0.751 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.661 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.559 ' H ' HD23 ' A' ' 55' ' ' LEU . 87.9 tttt -67.76 -62.03 1.6 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 117.057 0.429 . . . . 0.0 110.987 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.87 102.83 3.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.551 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.4 mmt -70.65 -25.29 62.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.17 0.51 . . . . 0.0 110.168 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.45 -31.11 70.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.777 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -88.87 -25.63 22.05 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.85 -170.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.438 ' O ' HD21 ' A' ' 23' ' ' LEU . 99.7 m -74.25 -34.58 63.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.189 0.519 . . . . 0.0 109.764 173.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -62.2 -47.29 85.12 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.893 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -76.14 -48.15 21.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.678 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.82 -32.3 72.75 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -174.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.54 ' CB ' HD11 ' A' ' 25' ' ' LEU . 4.1 mm? -88.9 -17.42 29.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.667 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 60.61 36.25 19.77 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -170.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.784 HD23 HG12 ' A' ' 30' ' ' VAL . 2.0 tp -57.08 121.81 49.06 Favored Pre-proline 0 N--CA 1.456 -0.138 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.801 -172.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -68.54 155.67 68.22 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.694 2.263 . . . . 0.0 110.804 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.683 ' HA ' HG23 ' A' ' 30' ' ' VAL . 52.7 p30 -70.9 -20.53 62.49 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.587 -175.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 m -66.38 -37.52 85.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 109.876 173.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.641 HG11 ' OD2' ' A' ' 45' ' ' ASP . 61.7 t -73.58 -51.43 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.885 -177.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.784 HG12 HD23 ' A' ' 25' ' ' LEU . 35.5 m -57.42 -36.31 52.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 120.937 0.399 . . . . 0.0 110.931 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.62 -51.71 57.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.731 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.14 -25.25 60.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.144 0.497 . . . . 0.0 110.167 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.6 tp -56.59 -52.75 63.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.406 174.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -74.57 10.04 1.52 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -65.36 126.21 27.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.852 0.751 . . . . 0.0 111.184 -175.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -82.87 -35.05 26.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.349 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -72.73 134.25 44.92 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.005 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -77.54 67.76 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.217 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -43.69 -54.71 4.87 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 171.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.0 t70 64.63 70.35 0.49 Allowed 'General case' 0 C--N 1.347 0.472 0 CA-C-O 121.699 0.762 . . . . 0.0 109.919 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -125.59 178.66 5.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.158 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 62.0 t -83.69 128.88 38.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 51.0 ttm -68.03 92.44 0.38 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.253 0.549 . . . . 0.0 109.669 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.1 p -92.12 -32.63 15.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.493 -174.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.641 ' OD2' HG11 ' A' ' 29' ' ' VAL . 13.7 t70 -70.87 129.84 40.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.401 0.62 . . . . 0.0 111.227 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -75.2 -20.88 59.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.296 -175.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.589 ' HB3' HD13 ' A' ' 25' ' ' LEU . 3.4 mm? -78.34 -15.73 58.42 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.109 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.0 -62.49 1.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -177.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.74 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -41.3 -48.12 4.55 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 114.845 -1.071 . . . . 0.0 114.475 169.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.3 m -66.97 -42.63 84.81 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.541 1.171 . . . . 0.0 111.794 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.01 -18.83 65.6 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 48' ' ' ALA . 46.3 mm -54.67 -40.25 50.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.277 175.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -118.6 77.15 1.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.024 177.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 t -125.28 -46.72 1.77 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.278 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.756 HD13 ' HB3' ' A' ' 9' ' ' SER . 7.5 mp -66.77 -74.95 0.1 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.413 0.625 . . . . 0.0 111.743 -170.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.14 -3.22 54.41 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.326 0.584 . . . . 0.0 110.069 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.531 HG21 ' CG1' ' A' ' 61' ' ' VAL . 81.1 m -83.63 -35.99 24.2 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.354 173.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.438 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.1 mtpt -77.49 -15.52 59.25 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.056 172.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 tp -64.94 -66.41 0.55 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.529 172.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -176.22 121.26 0.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.531 ' CG1' HG21 ' A' ' 57' ' ' THR . 12.5 p -179.47 43.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.622 0.725 . . . . 0.0 111.655 -176.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.56 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.3 m -105.97 121.46 58.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 110.366 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.619 ' HA ' HD21 ' A' ' 72' ' ' ASN . 1.8 t70 -64.55 -55.21 31.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.794 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.687 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.5 Cg_endo -97.72 -138.85 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.233 2.622 . . . . 0.0 113.298 -172.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.495 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -71.28 -5.51 32.79 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.226 -173.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 140.27 -56.75 0.61 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -170.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.687 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.6 p-10 -84.32 149.47 26.03 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.085 -0.557 . . . . 0.0 111.029 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.46 46.43 1.03 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.34 0.591 . . . . 0.0 110.799 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.618 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -75.14 81.42 2.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.534 0.683 . . . . 0.0 111.32 178.678 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -86.0 -63.25 1.35 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.232 -175.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.32 -60.27 8.88 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 121.278 -0.487 . . . . 0.0 113.05 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.619 HD21 ' HA ' ' A' ' 63' ' ' ASP . 13.9 m-20 -55.49 -29.04 58.06 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.29 -37.18 66.32 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.056 0.455 . . . . 0.0 110.919 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.545 ' O ' ' HG3' ' A' ' 78' ' ' MET . 72.6 mmtt -79.33 -33.67 42.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.04 -39.98 95.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.379 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.48 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 42.4 t80 -63.65 -32.51 74.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.396 177.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.71 -32.94 71.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.651 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 55.0 mtt -69.39 -28.12 65.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.859 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 76' ' ' PHE . 49.3 mtmt -86.31 -15.65 39.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.065 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -145.58 96.0 2.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.664 0.269 . . . . 0.0 111.199 -176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.08 -62.99 0.51 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.396 -0.906 . . . . 0.0 112.48 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.545 ' HB3' ' HB2' ' A' ' 86' ' ' MET . . . -104.08 139.48 39.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.746 0.308 . . . . 0.0 111.032 -177.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.608 ' OD1' HG21 ' A' ' 85' ' ' THR . 0.9 OUTLIER -88.11 175.97 7.49 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.408 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -54.47 -38.36 66.3 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.747 -171.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.608 HG21 ' OD1' ' A' ' 83' ' ' ASP . 8.3 t -73.69 -25.09 60.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.497 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.719 ' HA ' HE21 ' A' ' 89' ' ' GLN . 54.0 mtt -84.62 -39.61 18.46 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.447 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -39.26 92.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.352 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.61 -25.37 53.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.422 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.719 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -83.1 -23.43 33.06 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.334 -0.547 . . . . 0.0 110.071 173.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.572 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.1 tt -82.97 -48.17 10.96 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.481 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.417 ' HA ' HD12 ' A' ' 94' ' ' ILE . 16.6 m -57.33 -36.19 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.883 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -65.77 -41.3 92.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.009 0.433 . . . . 0.0 110.568 -176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.567 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.4 mp -62.46 -42.59 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.694 176.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 90' ' ' LEU . 34.2 mt -56.97 -48.13 82.16 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.152 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -67.0 -34.69 78.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.208 0.528 . . . . 0.0 110.233 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -48.81 5.57 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.705 -172.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 11.7 m -74.82 -31.45 61.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.734 -0.651 . . . . 0.0 112.669 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.497 ' CG ' HG12 ' A' ' 114' ' ' VAL . 37.5 mt-10 -57.36 -37.15 72.16 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.328 0.967 . . . . 0.0 109.833 166.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.654 ' HZ2' ' HB2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -72.79 -43.53 62.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.8 m -97.68 15.51 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -81.06 154.38 72.51 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.467 0.175 . . . . 0.0 110.573 177.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.405 ' HB2' ' OD1' ' A' ' 104' ' ' ASN . 13.8 Cg_exo -69.45 163.12 39.23 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.831 2.354 . . . . 0.0 110.939 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.44 40.72 0.29 Allowed 'Trans proline' 0 CA--C 1.534 0.515 0 C-N-CA 123.17 2.58 . . . . 0.0 113.379 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.405 ' OD1' ' HB2' ' A' ' 102' ' ' PRO . 2.6 m-20 -83.07 93.69 7.65 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -81.57 94.48 6.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.984 0.421 . . . . 0.0 110.825 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.83 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 10.1 t70 -133.14 107.36 8.15 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -28.79 -58.74 0.13 Allowed 'General case' 0 N--CA 1.473 0.693 0 O-C-N 124.967 1.417 . . . . 0.0 114.59 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.22 -15.99 22.83 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.83 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 12.9 ttt -85.18 -25.49 27.36 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -167.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.601 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.17 -47.08 86.61 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.292 1.044 . . . . 0.0 110.741 -177.51 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.601 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -53.94 -14.33 0.99 Allowed 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.29 174.308 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.74 HD13 ' HA3' ' A' ' 49' ' ' GLY . 1.6 mp -91.95 -41.68 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.524 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 1.0 OUTLIER -62.78 -32.43 73.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.735 176.644 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.586 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -80.39 -35.21 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 CA-C-O 121.211 0.529 . . . . 0.0 110.143 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.75 78.09 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.812 0.815 . . . . 0.0 111.557 174.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.697 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.57 -19.34 64.47 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.845 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 6.6 t -69.48 -30.32 68.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.105 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.489 ' HA ' HG12 ' A' ' 93' ' ' ILE . 62.9 t80 -70.99 -43.38 68.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.844 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.56 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 0.9 OUTLIER -69.35 -29.63 67.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.95 -1.1 . . . . 0.0 110.501 176.322 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.697 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -56.1 -47.88 77.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.413 0.625 . . . . 0.0 109.97 168.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.47 ' HG2' HD12 ' A' ' 93' ' ' ILE . 9.4 tp10 -57.09 -50.0 74.15 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.595 176.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.439 HD11 HG21 ' A' ' 122' ' ' ILE . 0.4 OUTLIER -56.63 -31.26 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 120.629 0.252 . . . . 0.0 111.211 177.763 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.74 -32.09 67.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.656 ' O ' ' HD3' ' A' ' 124' ' ' LYS . 9.8 tmtt? -72.15 -27.9 62.9 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 115.135 -0.938 . . . . 0.0 111.976 179.384 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo . . . . . 0 CA--C 1.527 0.17 0 CA-C-O 120.715 0.214 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -46.48 -66.12 0.45 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.492 HD11 ' HB3' ' A' ' 82' ' ' ALA . 8.3 tp -81.3 -10.33 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.915 0.388 . . . . 0.0 111.56 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.35 -23.69 57.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.127 0.489 . . . . 0.0 110.037 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -91.12 114.92 27.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.273 172.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -62.35 138.79 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.964 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.18 -40.06 70.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.691 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 p -64.62 -34.85 79.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.144 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -71.58 -33.78 69.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.334 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.65 -53.87 24.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.549 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -46.67 -71.91 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.935 169.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.43 37.44 60.23 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.683 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -80.78 -49.72 10.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.152 0.501 . . . . 0.0 110.061 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.568 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -160.12 106.14 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.419 177.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 61.3 mtm -76.83 -21.15 55.47 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 175.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 32.0 t70 -58.8 -27.63 65.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.092 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.7 pt20 -84.07 -24.74 30.26 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.116 0.484 . . . . 0.0 109.884 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 63.5 m -73.45 -29.89 62.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 55.7 tptt -62.67 -53.42 54.72 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.721 177.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -69.69 -43.77 71.79 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.041 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -69.51 -41.18 76.4 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.293 -174.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.493 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 7.1 mt -82.07 -16.58 49.59 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.613 -177.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.0 m 57.79 43.31 22.06 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.564 HD22 HD11 ' A' ' 47' ' ' LEU . 50.1 mt -57.65 129.71 81.25 Favored Pre-proline 0 N--CA 1.468 0.433 0 CA-C-N 114.669 -1.151 . . . . 0.0 110.262 -175.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 20.6 Cg_exo -65.88 155.83 67.34 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 121.95 1.767 . . . . 0.0 110.449 173.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.85 -34.82 70.13 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.069 0.462 . . . . 0.0 111.032 -176.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 m -70.18 -42.1 72.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.235 -176.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.539 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.4 t -72.62 -53.85 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.63 -173.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.683 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.9 p -59.64 -30.64 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.177 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.87 -52.46 56.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.75 175.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.25 -38.1 68.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -176.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.683 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 2.4 pp -61.43 -32.56 72.53 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.742 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -64.67 8.18 0.13 Allowed 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 174.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -67.05 111.99 4.15 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.272 1.396 . . . . 0.0 111.011 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.31 -4.36 58.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.05 0.452 . . . . 0.0 110.56 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -90.03 145.29 25.19 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -83.31 58.53 4.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.437 0.637 . . . . 0.0 110.636 -178.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 5.5 t70 -42.6 -40.68 2.78 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 40.9 m-20 78.62 25.41 0.54 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.783 0.72 . . . . 0.0 111.155 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.43 175.82 9.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 0.0 110.957 178.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.32 124.56 52.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.487 ' HE3' HD11 ' A' ' 52' ' ' ILE . 45.9 ttm -78.84 92.74 4.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.049 0.452 . . . . 0.0 110.484 -178.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 -30.91 13.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.71 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.39 135.14 48.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 122.005 0.907 . . . . 0.0 110.827 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.84 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 1.5 mpt_? -73.69 -30.94 63.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.845 -1.525 . . . . 0.0 109.919 -170.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.564 HD11 HD22 ' A' ' 25' ' ' LEU . 4.1 mm? -73.64 -15.63 61.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.032 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.88 -59.22 2.49 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.931 ' HA3' HD12 ' A' ' 112' ' ' ILE . . . -38.82 -47.07 2.35 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 115.361 -0.836 . . . . 0.0 114.057 166.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -66.5 -41.07 89.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.452 1.126 . . . . 0.0 111.752 177.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.9 -18.06 65.2 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.487 HD11 ' HE3' ' A' ' 43' ' ' MET . 46.2 mm -56.78 -37.34 52.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.921 0.391 . . . . 0.0 110.671 176.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.403 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 60.3 t30 -141.08 86.59 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 0.0 110.307 178.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.7 p -106.82 -46.85 3.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.473 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -68.2 -44.98 74.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.086 -174.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.467 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.26 -13.32 58.61 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.9 0.381 . . . . 0.0 110.246 -174.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.658 ' HA ' HG12 ' A' ' 61' ' ' VAL . 91.3 m -79.05 -34.56 43.68 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.297 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -75.93 -20.93 57.58 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.433 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.467 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.5 mt -65.42 -66.19 0.58 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.482 175.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -177.19 116.59 0.1 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.658 HG12 ' HA ' ' A' ' 57' ' ' THR . 7.0 p -173.31 32.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 121.313 0.578 . . . . 0.0 111.52 -174.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.623 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 23.4 m -109.55 115.88 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 121.161 -0.962 . . . . 0.0 111.992 -175.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -74.51 -54.5 3.04 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.766 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.623 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 18.7 Cg_endo -99.15 -141.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 123.134 2.556 . . . . 0.0 113.246 -172.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -75.45 10.1 1.84 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.668 -175.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.38 -75.32 0.42 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.206 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.638 HD21 HD23 ' A' ' 68' ' ' LEU . 2.2 p-10 -70.35 152.86 43.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.962 -0.619 . . . . 0.0 110.8 177.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.638 HD23 HD21 ' A' ' 67' ' ' ASN . 3.9 mm? 69.13 34.81 2.92 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.574 0.546 . . . . 0.0 112.106 173.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.623 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 6.4 p-80 -73.31 77.53 1.34 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.738 0.78 . . . . 0.0 110.514 174.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -86.41 -61.71 1.68 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.746 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.94 56.21 Favored Glycine 0 CA--C 1.51 -0.275 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.444 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -58.71 -28.53 65.9 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.181 . . . . 0.0 111.44 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.56 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.23 -37.15 66.49 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.697 -0.627 . . . . 0.0 110.885 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.9 mmmt -81.03 -31.42 34.57 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.111 178.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.638 ' HA ' ' HE3' ' A' ' 78' ' ' MET . 27.2 t70 -64.73 -40.31 95.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.327 173.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -62.98 -32.35 73.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 176.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.89 -38.62 79.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.69 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.638 ' HE3' ' HA ' ' A' ' 75' ' ' ASP . 66.0 mtm -69.26 -27.69 65.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.315 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.915 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -91.42 -12.44 34.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.46 179.266 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -141.33 90.98 2.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 O-C-N 122.183 -0.323 . . . . 0.0 111.042 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 109.55 -62.49 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.432 -0.89 . . . . 0.0 113.524 173.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.564 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.38 124.36 34.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.634 0.254 . . . . 0.0 110.912 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.648 ' OD2' HG21 ' A' ' 85' ' ' THR . 4.6 p-10 -83.75 171.34 13.27 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.551 174.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -48.54 72.61 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.393 -164.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.767 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.0 t -61.0 -36.74 80.28 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.054 -173.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.451 ' HE2' ' OD1' ' A' ' 83' ' ' ASP . 50.4 mtm -81.01 -38.96 26.64 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.409 0.623 . . . . 0.0 109.5 -173.101 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.55 -39.64 84.65 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.165 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -72.32 -25.92 61.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.368 -177.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.767 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.1 mm-40 -77.99 -25.58 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 tp -88.13 -46.36 9.35 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.494 -176.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.441 ' HA ' HD12 ' A' ' 94' ' ' ILE . 15.4 m -56.92 -36.61 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.108 -173.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -65.73 -42.37 91.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.901 0.381 . . . . 0.0 110.579 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.6 mp -61.85 -38.88 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.041 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 90' ' ' LEU . 47.1 mt -59.91 -45.79 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.209 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -68.51 -34.45 75.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.29 -49.68 5.13 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.47 -0.872 . . . . 0.0 112.244 -173.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 7.7 m -73.33 -31.23 63.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.563 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.649 ' HG3' ' CG1' ' A' ' 114' ' ' VAL . 18.8 mt-10 -65.29 -34.43 78.32 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.401 1.001 . . . . 0.0 110.271 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -64.81 -44.03 91.22 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.171 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.6 m -101.49 9.11 41.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -174.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -67.66 150.34 97.87 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.413 ' C ' ' H ' ' A' ' 104' ' ' ASN . 37.5 Cg_exo -57.5 159.75 15.72 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 0.0 111.358 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.48 23.88 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.535 2.157 . . . . 0.0 113.078 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.413 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.8 m-20 -94.71 91.92 6.75 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.48 95.98 7.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.558 0.694 . . . . 0.0 110.427 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.4 t70 -101.26 133.69 45.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.791 177.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -29.39 -72.32 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 O-C-N 125.327 1.642 . . . . 0.0 112.947 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.0 t -96.41 -21.79 17.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.84 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 59.1 ttp -77.39 -15.75 59.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.883 -0.51 . . . . 0.0 112.237 -168.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.486 ' CG ' ' H ' ' A' ' 111' ' ' THR . 12.1 ptmm? -56.27 -51.76 66.99 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 122.431 1.11 . . . . 0.0 109.355 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.486 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -60.18 -13.0 10.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.446 173.011 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.931 HD12 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -89.02 -40.58 13.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.29 -37.26 84.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.652 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.649 ' CG1' ' HG3' ' A' ' 98' ' ' GLU . 12.1 m -77.61 -35.67 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.885 178.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.451 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -62.14 -49.27 76.55 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.17 0.51 . . . . 0.0 111.204 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.527 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 21.6 ptt? -69.79 -17.91 63.44 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.478 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.931 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 39.5 t -69.46 -32.78 71.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 122.143 0.973 . . . . 0.0 109.022 176.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -74.11 -38.11 63.93 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.93 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.577 ' HD2' ' C ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -67.66 -26.37 66.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 118.364 -1.334 . . . . 0.0 111.629 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.931 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -64.72 -56.36 14.19 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.539 -1.265 . . . . 0.0 109.354 172.05 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.0 -41.65 88.17 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.944 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.433 HD11 HG21 ' A' ' 122' ' ' ILE . 0.4 OUTLIER -59.26 -35.18 56.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.305 0.502 . . . . 0.0 110.697 176.296 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -72.06 -30.52 65.23 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 176.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -72.5 -33.71 67.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.121 0.486 . . . . 0.0 110.146 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 CA--C 1.536 0.429 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.412 171.284 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo . . . . . 0 N--CA 1.458 -0.58 0 N-CA-C 112.645 0.209 . . . . 0.0 112.645 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -50.17 -70.61 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.903 0.752 . . . . 0.0 112.376 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.5 tt -87.2 -10.75 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.61 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 51.1 ttp -62.65 -40.76 98.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.469 0.652 . . . . 0.0 109.53 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -92.18 100.59 13.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.568 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -61.54 124.77 21.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.309 -172.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.12 -30.61 71.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.143 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.495 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 3.4 p -69.31 -35.34 75.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.577 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.4 -26.59 61.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.278 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.55 -40.01 84.98 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.495 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 33.0 m-85 -55.02 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.341 168.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.64 36.08 17.73 Favored Glycine 0 C--N 1.346 1.085 0 C-N-CA 121.108 -0.568 . . . . 0.0 113.747 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.472 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 2.2 tmmm? -65.88 -39.14 90.4 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.026 0.441 . . . . 0.0 110.58 -177.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.01 96.91 2.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.131 0.491 . . . . 0.0 111.498 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -80.14 -32.71 38.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -56.59 -40.49 75.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.307 -1.315 . . . . 0.0 111.693 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -88.12 -24.78 23.29 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.42 -169.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.2 t -73.37 -36.07 66.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 119.949 -0.7 . . . . 0.0 109.138 173.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 1.064 ' HA ' HD12 ' A' ' 25' ' ' LEU . 10.6 tptt -63.44 -39.29 94.09 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.643 0.735 . . . . 0.0 109.877 176.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -69.19 -40.92 77.76 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.651 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -71.46 -44.47 64.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.756 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 10.6 mt -86.35 -4.8 59.24 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.463 -175.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.3 t 63.3 34.26 13.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.509 176.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 1.064 HD12 ' HA ' ' A' ' 20' ' ' LYS . 6.4 mp -50.42 119.24 10.66 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.931 -176.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.49 ' HD3' HD23 ' A' ' 47' ' ' LEU . 13.0 Cg_exo -73.75 162.89 38.55 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.979 2.453 . . . . 0.0 111.655 174.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.596 ' HA ' HG23 ' A' ' 30' ' ' VAL . 6.4 p-10 -62.81 -29.67 70.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -174.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 t -68.18 -37.61 81.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.339 0.59 . . . . 0.0 110.03 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.836 HG22 HD21 ' A' ' 47' ' ' LEU . 41.5 t -75.45 -49.96 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.706 -177.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.596 HG23 ' HA ' ' A' ' 27' ' ' ASP . 16.6 m -55.91 -35.12 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.672 0.272 . . . . 0.0 110.749 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.57 69.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 0.0 111.632 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -68.43 -38.33 81.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.9 0.857 . . . . 0.0 109.17 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 3.1 tm? -55.76 -55.67 29.61 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.996 175.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -67.9 12.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.777 HD22 ' HB2' ' A' ' 39' ' ' ASP . 33.8 t30 -56.19 110.96 0.84 Allowed 'General case' 0 C--N 1.35 0.6 0 CA-C-N 120.051 1.296 . . . . 0.0 110.547 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -78.71 -27.86 45.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.679 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -88.3 157.77 18.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 -174.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.454 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 7.1 mptt -82.83 61.24 5.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.764 -175.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.777 ' HB2' HD22 ' A' ' 35' ' ' ASN . 1.0 OUTLIER -43.79 -48.21 8.12 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.628 176.108 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 68.19 19.68 9.06 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 118.258 0.481 . . . . 0.0 111.016 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -78.42 179.12 7.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.005 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 t -89.66 130.61 38.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.318 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 42.3 ttm -65.29 104.47 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.089 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.0 p -87.25 -40.62 14.36 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -173.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.499 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 6.2 t70 -90.64 117.48 29.33 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-O 122.284 1.04 . . . . 0.0 110.718 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.59 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.02 -38.45 62.38 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 113.161 -1.836 . . . . 0.0 112.242 175.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.836 HD21 HG22 ' A' ' 29' ' ' VAL . 46.5 tp -68.82 -18.18 64.13 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.939 0.399 . . . . 0.0 111.05 -174.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.7 -55.99 5.01 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.72 -45.37 1.48 Allowed Glycine 0 CA--C 1.533 1.159 0 CA-C-N 114.727 -1.124 . . . . 0.0 114.41 165.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 57.5 m -65.54 -43.41 90.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 118.09 0.945 . . . . 0.0 110.319 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.422 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -68.39 -25.45 65.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.776 -176.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.4 mt -77.24 -26.66 15.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 110.33 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.76 44.36 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 -45.18 2.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.5 -170.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.609 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 3.2 mm? -46.46 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.19 -15.49 53.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.811 0.338 . . . . 0.0 110.899 -172.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -78.62 -32.06 47.26 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.746 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.643 ' HZ3' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.52 -23.43 34.61 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.779 174.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 10.6 mt -63.38 -59.95 4.01 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 121.179 -0.209 . . . . 0.0 111.249 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -174.01 122.53 0.31 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -176.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.522 HG23 ' HB3' ' A' ' 72' ' ' ASN . 9.8 p -177.11 33.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 121.59 0.71 . . . . 0.0 111.142 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.63 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 35.5 m -98.3 114.07 34.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 O-C-N 121.25 -0.907 . . . . 0.0 110.579 -176.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -56.75 4.1 Favored Pre-proline 0 CA--C 1.53 0.198 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.237 -176.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.593 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 4.4 Cg_endo -91.81 -144.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.815 2.343 . . . . 0.0 112.715 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.425 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -74.64 10.5 1.34 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.371 -176.393 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.01 -75.55 0.31 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.572 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.593 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.2 p-10 -75.06 168.61 19.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.051 -0.575 . . . . 0.0 111.075 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.583 HD21 HD21 ' A' ' 67' ' ' ASN . 3.6 mm? 70.12 28.62 3.99 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 123.76 0.663 . . . . 0.0 111.952 173.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 7.9 p80 -76.83 65.9 2.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.402 0.62 . . . . 0.0 110.832 172.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -88.9 -49.75 6.61 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.138 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.11 -51.86 54.84 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.502 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.522 ' HB3' HG23 ' A' ' 61' ' ' VAL . 1.6 t-20 -59.24 -35.65 74.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.72 -0.24 . . . . 0.0 111.512 -176.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.86 -37.07 70.28 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.1 0.476 . . . . 0.0 111.068 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.604 ' O ' ' HG3' ' A' ' 78' ' ' MET . 5.2 mmmp? -80.64 -36.14 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.828 -178.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.639 ' HA ' ' HE1' ' A' ' 78' ' ' MET . 26.0 t70 -65.58 -41.04 93.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -60.63 -37.8 82.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.088 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.79 71.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.298 178.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.639 ' HE1' ' HA ' ' A' ' 75' ' ' ASP . 65.1 mtm -74.36 -34.96 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.797 0.332 . . . . 0.0 111.803 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -93.88 -8.42 40.34 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.93 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -141.89 88.53 2.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.72 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.17 -74.79 0.43 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.424 -0.893 . . . . 0.0 112.621 177.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.532 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -107.66 141.13 39.64 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 165.63 23.77 Favored 'General case' 0 CA--C 1.489 -1.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 11.2 pt-20 -67.49 -21.39 65.51 Favored 'General case' 0 N--CA 1.409 -2.484 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.628 -164.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.71 -28.2 63.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.643 -179.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.647 ' HA ' HE21 ' A' ' 89' ' ' GLN . 38.8 mtt -83.74 -39.76 19.69 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -65.59 -37.74 87.51 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.718 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.458 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -77.71 -27.01 50.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.8 -174.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.647 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.9 pt20 -79.96 -24.19 41.15 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.209 172.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.488 ' O ' HG13 ' A' ' 94' ' ' ILE . 25.6 tp -81.41 -46.15 15.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.13 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 87' ' ' ALA . 17.7 m -57.57 -33.32 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.959 -175.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.77 -45.16 87.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.326 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.468 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -67.66 -40.0 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 90' ' ' LEU . 74.2 mt -54.43 -50.05 60.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.275 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -71.76 -33.41 68.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.645 -174.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.1 -49.55 5.53 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.684 -174.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.502 ' HB3' ' HA ' ' A' ' 114' ' ' VAL . 0.1 OUTLIER -72.63 -28.59 62.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.796 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.587 ' HB2' HG12 ' A' ' 114' ' ' VAL . 35.9 tt0 -62.33 -38.62 90.15 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.672 0.273 . . . . 0.0 111.405 170.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -67.43 -33.69 75.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.893 0.378 . . . . 0.0 110.481 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.5 m -96.38 8.76 43.2 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.279 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.61 155.59 87.22 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.705 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 92.2 Cg_exo -45.08 140.59 7.25 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.159 2.573 . . . . 0.0 112.425 176.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.8 Cg_exo -69.59 24.81 0.17 Allowed 'Trans proline' 0 N--CA 1.476 0.469 0 C-N-CA 123.695 2.93 . . . . 0.0 113.703 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 102' ' ' PRO . 89.3 m-20 -109.04 93.95 4.78 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -76.46 95.13 3.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.648 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.7 t70 -121.2 124.42 44.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.275 172.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.568 ' HD2' ' H ' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -33.81 -51.31 0.39 Allowed 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -178.346 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.568 ' H ' ' HD2' ' A' ' 107' ' ' LYS . 91.4 m -92.4 -30.71 15.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.648 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 62.6 mmm -61.67 -46.08 91.27 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 122.1 0.953 . . . . 0.0 110.162 -176.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.619 ' O ' HG13 ' A' ' 114' ' ' VAL . 15.8 ptmt -66.09 -50.56 63.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.485 -178.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.532 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -58.66 -15.33 11.28 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.27 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.536 HD11 ' O ' ' A' ' 108' ' ' CYS . 1.5 mp -89.16 -39.67 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -38.97 87.44 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.188 174.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.619 HG13 ' O ' ' A' ' 110' ' ' LYS . 2.8 m -80.13 -39.33 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 121.497 0.665 . . . . 0.0 110.11 -173.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.78 -41.39 99.23 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.03 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.642 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -67.33 -24.52 65.74 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.49 -177.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 86.6 m -66.63 -30.74 71.08 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.183 0.516 . . . . 0.0 109.943 174.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.468 ' HB2' HG22 ' A' ' 93' ' ' ILE . 88.9 t80 -70.07 -40.64 74.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.246 177.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.635 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.5 OUTLIER -68.49 -20.4 64.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.898 177.366 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.642 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.84 -49.26 71.29 Favored 'General case' 0 C--N 1.342 0.28 0 O-C-N 121.815 -0.553 . . . . 0.0 109.559 168.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 10.1 mm-40 -58.7 -50.84 72.38 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.165 176.139 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.635 HG23 ' HA ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -54.12 -36.12 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 117.629 0.195 . . . . 0.0 111.24 178.725 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.616 ' N ' HG22 ' A' ' 122' ' ' ILE . 3.9 m170 -70.55 -32.65 70.16 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -68.87 -35.6 77.1 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 110.079 175.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 72.1 mt . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.6 174.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.758 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 19.0 Cg_endo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 113.95 0.712 . . . . 0.0 113.95 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.402 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.3 mp0 -45.03 -67.56 0.27 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.389 0.43 . . . . 0.0 111.281 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 tp -87.68 -11.04 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.84 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.758 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.9 mtp -72.9 -21.44 60.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.957 0.408 . . . . 0.0 110.947 -178.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -86.7 81.14 8.32 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 171.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.574 ' ND2' HG13 ' A' ' 52' ' ' ILE . 3.8 m-20 -61.75 130.39 45.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.886 -176.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.426 HD23 HD21 ' A' ' 11' ' ' ASN . 84.7 mt -58.3 -33.78 69.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.51 -178.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.4 t -62.03 -39.41 92.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 109.956 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -76.13 -31.16 58.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.787 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.426 HD21 HD23 ' A' ' 8' ' ' LEU . 87.0 m-20 -67.92 -49.55 61.23 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -48.26 -74.2 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.942 170.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 52.66 35.59 46.32 Favored Glycine 0 C--N 1.344 0.981 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.477 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -73.95 -37.51 64.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 121.053 0.454 . . . . 0.0 110.319 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.424 ' H ' HD12 ' A' ' 55' ' ' LEU . . . -144.52 104.36 4.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.525 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 53.2 ttm -81.16 -32.29 33.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.241 0.544 . . . . 0.0 109.569 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.8 -33.0 68.1 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.7 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -88.1 -25.01 23.23 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.076 -0.65 . . . . 0.0 111.362 -173.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.45 -34.95 70.71 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -63.68 -48.1 78.55 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.374 0.607 . . . . 0.0 110.205 176.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.4 -47.6 60.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.465 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.444 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 2.8 tp10 -69.51 -35.14 75.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.451 0.167 . . . . 0.0 111.349 -173.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.663 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 3.9 mm? -77.31 -22.19 52.32 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 120.939 0.4 . . . . 0.0 110.423 176.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.1 m 58.55 41.52 22.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.53 -169.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.663 ' HG ' ' CB ' ' A' ' 23' ' ' LEU . 55.9 mt -65.68 139.43 97.03 Favored Pre-proline 0 CA--C 1.516 -0.342 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.861 -172.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.584 ' HG2' HG23 ' A' ' 29' ' ' VAL . 75.1 Cg_endo -82.24 163.64 17.37 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.734 2.289 . . . . 0.0 110.259 170.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.82 -33.44 75.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.757 0.313 . . . . 0.0 111.17 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.2 p -67.89 -47.36 69.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 -178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.584 HG23 ' HG2' ' A' ' 26' ' ' PRO . 65.1 t -73.43 -46.94 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.377 -173.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.51 -32.2 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 118.743 0.701 . . . . 0.0 110.634 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.44 -52.01 37.45 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.806 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -66.84 -33.92 76.67 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.6 tp -49.43 -53.98 19.95 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.931 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -65.58 11.89 0.06 Allowed 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.75 98.91 0.21 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.813 1.642 . . . . 0.0 109.789 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -73.5 -20.83 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.129 -174.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -76.76 147.41 37.31 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.408 ' HB3' ' HE3' ' A' ' 5' ' ' MET . 16.7 ptpt -76.08 67.52 2.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.863 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.648 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 3.1 t70 -43.44 -52.23 6.14 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.601 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 26.9 t70 73.19 20.41 3.34 Favored 'General case' 0 C--N 1.355 0.842 0 CA-C-O 122.243 1.021 . . . . 0.0 109.583 -177.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.648 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -85.17 177.97 7.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.359 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.8 t -89.84 126.69 42.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.942 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.8 ttm -71.66 103.43 3.04 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.28 -40.95 17.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.18 -172.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.477 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.0 t70 -89.06 116.63 27.47 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.771 0.796 . . . . 0.0 110.316 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.651 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -54.12 -37.13 64.01 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.901 -1.499 . . . . 0.0 112.257 176.239 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.581 HD23 ' HD3' ' A' ' 26' ' ' PRO . 27.9 tp -66.54 -15.25 63.26 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.286 0.565 . . . . 0.0 110.813 -174.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.31 -51.6 8.7 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.805 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -40.34 -45.76 3.34 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.004 -0.998 . . . . 0.0 114.366 165.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.503 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 4.0 m -62.0 -46.35 89.61 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.621 1.21 . . . . 0.0 110.061 177.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.28 1.74 27.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.006 -175.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.574 HG13 ' ND2' ' A' ' 7' ' ' ASN . 1.9 tp -62.54 -26.91 41.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 173.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -147.32 86.07 1.61 Allowed 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.394 174.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.75 -45.28 5.28 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.524 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.513 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 mt -70.24 -44.48 68.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 0.0 111.49 -173.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -13.2 59.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.696 ' HA ' HG11 ' A' ' 61' ' ' VAL . 98.9 m -83.09 -36.75 24.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.164 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 25.0 mtpp -71.52 -21.43 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.56 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 53.4 mt -65.35 -65.67 0.64 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.373 175.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -175.45 113.11 0.13 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.314 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.696 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.0 p -175.38 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.594 0.712 . . . . 0.0 111.408 -177.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.682 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.4 m -103.66 120.9 54.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 120.888 -1.132 . . . . 0.0 111.088 -177.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.33 -56.18 5.51 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.74 177.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.0 Cg_endo -97.06 -139.21 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.228 2.619 . . . . 0.0 112.761 -171.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.473 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 65.0 m-20 -75.67 11.94 1.19 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.404 -173.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.32 -71.6 0.5 Allowed Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -174.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.619 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p-10 -77.51 156.03 31.26 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.824 -0.688 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.75 41.39 1.21 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.382 0.611 . . . . 0.0 111.833 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.682 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 5.5 p80 -78.25 80.11 4.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.15 177.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -86.88 -62.59 1.47 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.055 -178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.07 -54.75 35.43 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.685 -177.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -56.08 -34.66 66.18 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.626 0.251 . . . . 0.0 111.347 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.524 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -66.91 -35.78 80.78 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.246 0.545 . . . . 0.0 111.006 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.5 mmmt -79.79 -40.01 29.58 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.316 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.59 -39.73 94.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.812 0.339 . . . . 0.0 110.276 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -57.88 -40.85 81.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.541 175.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.04 78.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.716 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.562 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 56.2 mtt -69.93 -39.45 76.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.001 0.429 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -89.08 -9.34 51.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.96 0.409 . . . . 0.0 110.556 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -143.69 91.24 2.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.411 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 118.3 -76.43 0.29 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.565 175.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.418 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -85.04 137.02 33.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.653 0.264 . . . . 0.0 110.697 -176.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -79.2 154.96 28.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 121.369 0.604 . . . . 0.0 109.762 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -63.39 -43.83 96.46 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.985 -167.162 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 2.8 m -51.57 -45.68 63.19 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.863 174.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.433 ' HE2' ' HB2' ' A' ' 86' ' ' MET . 2.7 ptm -76.32 -39.33 54.35 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.413 0.625 . . . . 0.0 109.419 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.538 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -61.03 -36.38 79.38 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.02 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.744 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.7 mp0 -70.8 -25.27 62.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.976 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.4 mm-40 -78.08 -24.46 47.63 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 94' ' ' ILE . 23.4 tp -87.23 -46.16 9.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.683 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.744 HG22 ' HA ' ' A' ' 88' ' ' GLN . 5.2 m -60.89 -28.51 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -44.17 93.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.63 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.8 mp -67.52 -41.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.118 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 90' ' ' LEU . 54.5 mt -57.5 -46.95 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.247 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -70.14 -33.85 72.32 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.418 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -54.93 3.23 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.151 -1.023 . . . . 0.0 112.263 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.0 m -72.97 -31.39 64.5 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.496 ' N ' HG13 ' A' ' 114' ' ' VAL . 42.3 tt0 -68.13 -36.39 79.63 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.456 1.025 . . . . 0.0 110.789 171.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -64.27 -43.21 95.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.918 0.39 . . . . 0.0 110.858 177.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 m -104.1 25.53 9.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.25 155.42 92.36 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.297 178.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.464 ' C ' ' H ' ' A' ' 104' ' ' ASN . 50.8 Cg_exo -53.7 155.23 14.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.594 2.196 . . . . 0.0 111.699 176.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 15.1 Cg_exo -70.22 24.64 0.19 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.232 2.621 . . . . 0.0 113.191 -177.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.464 ' H ' ' C ' ' A' ' 102' ' ' PRO . 85.2 m-20 -105.4 93.37 4.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -79.5 95.43 5.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.811 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.3 t0 -105.56 120.39 41.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.077 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -29.03 -73.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 O-C-N 125.312 1.633 . . . . 0.0 113.689 -176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.489 ' O ' HG22 ' A' ' 111' ' ' THR . 18.0 t -97.68 -7.26 31.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.811 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.4 ttt -82.56 -28.2 31.1 Favored 'General case' 0 C--O 1.251 1.134 0 O-C-N 121.417 -0.802 . . . . 0.0 113.005 -168.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.661 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.2 OUTLIER -56.94 -45.15 82.96 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.929 0.871 . . . . 0.0 110.736 -173.125 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.661 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.6 t -58.87 -10.59 2.53 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 0.0 113.126 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.805 HD13 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -91.5 -39.56 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.635 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 9.7 m-20 -58.23 -38.87 77.7 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.222 174.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.631 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 6.3 m -84.88 -31.38 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 CA-C-O 121.416 0.627 . . . . 0.0 110.041 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -61.12 -46.35 90.93 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.246 173.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.635 ' HE3' ' HA ' ' A' ' 113' ' ' ASP . 19.3 ptt? -67.95 -20.45 65.06 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.111 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.871 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 21.4 t -68.69 -30.26 68.89 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.482 0.658 . . . . 0.0 109.263 174.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.63 ' HA ' HG12 ' A' ' 93' ' ' ILE . 71.6 t80 -77.16 -49.37 15.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.298 -178.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.5 ' HE3' ' C ' ' A' ' 119' ' ' LYS 0.254 0.0 OUTLIER -70.96 -16.55 62.66 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.072 177.757 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.871 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -62.26 -54.38 41.61 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.303 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -58.72 -48.96 79.36 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.343 174.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -33.99 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 122.002 -0.436 . . . . 0.0 111.326 178.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -71.98 -31.61 66.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.96 -0.463 . . . . 0.0 111.767 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -66.6 -37.44 84.9 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.924 0.392 . . . . 0.0 110.527 175.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 70.2 mt . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.848 172.32 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.559 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 13.0 Cg_endo . . . . . 0 CA--C 1.529 0.256 0 N-CA-C 112.8 0.269 . . . . 0.0 112.8 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.04 -69.7 0.12 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.127 174.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.581 ' HB ' ' HE2' ' A' ' 86' ' ' MET . 10.6 tp -73.91 -13.43 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.559 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.3 ttt -72.39 -29.97 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.059 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -81.52 96.84 7.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.44 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.401 HD22 HG21 ' A' ' 52' ' ' ILE . 25.8 t-20 -66.55 128.46 36.3 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.494 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 22.2 mt -54.94 -45.64 74.88 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -176.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -66.12 -35.51 80.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.453 0.168 . . . . 0.0 110.914 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -70.45 -36.68 74.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.136 0.493 . . . . 0.0 110.482 177.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -67.3 -55.36 14.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.907 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 31.2 m-85 -50.41 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.49 -0.777 . . . . 0.0 113.036 173.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.06 35.69 54.78 Favored Glycine 0 C--N 1.342 0.911 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.188 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.445 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 9.0 tmtt? -85.44 -36.81 20.39 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.985 0.422 . . . . 0.0 110.155 -176.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.55 88.38 2.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.28 0.562 . . . . 0.0 110.873 -176.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.6 mtm -82.53 -45.62 14.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.051 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -60.24 -44.61 95.1 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.119 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.443 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 3.7 mm100 -87.23 -21.05 26.08 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.279 -171.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -75.72 -31.9 59.83 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 170.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.661 ' HE2' HG13 ' A' ' 30' ' ' VAL . 27.5 tptp -57.8 -55.39 35.51 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.49 178.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -73.85 -39.57 63.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.09 -177.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.522 ' CD ' ' HZ1' ' A' ' 58' ' ' LYS . 19.1 tt0 -70.35 -32.73 70.56 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -172.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.5 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -83.8 -1.16 53.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.019 0.438 . . . . 0.0 110.08 178.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t 63.81 29.06 14.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.901 -177.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.565 HD13 ' HA ' ' A' ' 20' ' ' LYS . 21.3 mt -70.62 128.34 91.11 Favored Pre-proline 0 N--CA 1.45 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.521 -172.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.753 ' HD3' HD23 ' A' ' 47' ' ' LEU . 57.6 Cg_endo -79.76 151.92 22.11 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 121.798 1.666 . . . . 0.0 108.847 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -31.83 66.31 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.871 -176.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 p -65.06 -52.81 53.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.653 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.521 HG23 ' HG2' ' A' ' 26' ' ' PRO . 90.0 t -69.5 -50.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -175.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.661 HG13 ' HE2' ' A' ' 20' ' ' LYS . 9.6 p -61.18 -32.75 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.827 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.05 -46.67 50.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.953 0.406 . . . . 0.0 111.12 177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.28 -38.25 88.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.182 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.724 HD11 ' HB2' ' A' ' 48' ' ' ALA . 23.4 tp -55.7 -56.86 15.47 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.855 171.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -68.59 11.64 0.17 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -52.12 125.44 15.68 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 120.24 1.382 . . . . 0.0 110.223 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -70.21 -33.68 71.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.631 -175.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -90.5 142.91 27.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.561 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -75.8 78.21 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.42 0.629 . . . . 0.0 110.918 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -42.83 -46.72 5.36 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.759 173.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 70.42 32.25 2.78 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.835 0.826 . . . . 0.0 110.112 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.28 175.69 9.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.836 175.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.0 t -90.95 127.3 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 169.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.67 ' HE1' HD12 ' A' ' 52' ' ' ILE . 49.9 ttm -69.31 94.38 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.181 0.515 . . . . 0.0 109.797 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 p -85.01 -36.26 21.4 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.141 -174.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.535 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.8 t70 -87.04 117.0 25.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.754 0.788 . . . . 0.0 110.597 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.621 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.39 -37.5 62.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.354 175.612 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.753 HD23 ' HD3' ' A' ' 26' ' ' PRO . 33.4 tp -68.92 -14.87 63.3 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.234 0.54 . . . . 0.0 111.013 -172.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.724 ' HB2' HD11 ' A' ' 33' ' ' LEU . . . -76.74 -54.83 6.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.94 -47.17 1.85 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.505 166.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 5.9 m -63.16 -45.02 93.83 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.242 1.021 . . . . 0.0 110.645 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.528 ' HB1' HD21 ' A' ' 25' ' ' LEU . . . -72.34 -11.41 60.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.276 -176.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.67 HD12 ' HE1' ' A' ' 43' ' ' MET . 67.6 mt -58.67 -39.03 74.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 109.846 173.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.58 84.81 2.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.597 0.713 . . . . 0.0 110.425 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -116.32 -48.26 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.751 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.32 -48.29 23.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 111.484 -172.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' HZ ' ' A' ' 76' ' ' PHE . . . -81.01 -15.61 55.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.366 0.603 . . . . 0.0 109.958 -174.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.806 HG21 HG12 ' A' ' 61' ' ' VAL . 55.4 m -80.71 -35.89 32.91 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.267 174.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.522 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 50.2 mtpt -71.8 -22.46 61.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 176.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -63.67 -64.04 1.01 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.059 175.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -175.24 119.86 0.19 Allowed 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.806 HG12 HG21 ' A' ' 57' ' ' THR . 10.4 p -171.11 32.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.645 0.736 . . . . 0.0 111.096 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.612 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 1.3 m -108.12 122.08 62.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.037 -1.04 . . . . 0.0 111.2 -175.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -53.58 2.77 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.013 177.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.641 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 22.7 Cg_endo -99.72 -139.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.08 2.52 . . . . 0.0 113.326 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.47 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.5 t70 -72.9 10.67 0.83 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.477 -173.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.75 -67.84 0.55 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.203 -0.998 . . . . 0.0 111.523 -173.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.692 HD21 HD23 ' A' ' 68' ' ' LEU . 2.8 p-10 -82.37 154.93 24.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.95 -0.625 . . . . 0.0 111.243 -178.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.692 HD23 HD21 ' A' ' 67' ' ' ASN . 4.4 mm? 69.32 38.57 1.82 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.228 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.612 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 14.3 p80 -75.78 81.06 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.371 0.605 . . . . 0.0 111.233 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -86.41 -61.67 1.69 Allowed 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.744 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.97 -56.37 25.11 Favored Glycine 0 CA--C 1.508 -0.378 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.79 -175.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -55.49 -29.63 59.14 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 123.712 0.301 . . . . 0.0 111.44 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.557 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.74 -36.51 65.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.36 0.6 . . . . 0.0 111.235 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.576 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.2 mmmt -79.18 -39.8 32.46 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.417 ' O ' ' HD2' ' A' ' 79' ' ' LYS . 21.4 t70 -60.7 -41.02 94.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.976 174.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.584 ' HZ ' ' HB2' ' A' ' 56' ' ' ALA . 54.3 t80 -56.44 -42.78 78.68 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.084 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.37 -25.19 63.15 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.483 -0.487 . . . . 0.0 111.264 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.576 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 48.4 mtt -68.39 -39.48 81.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.357 178.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.417 ' HD2' ' O ' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -93.41 -7.84 43.46 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.466 178.001 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -134.71 89.21 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.711 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 123.32 -68.65 0.47 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.329 -0.939 . . . . 0.0 112.9 171.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.1 150.48 20.79 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.032 0.444 . . . . 0.0 111.478 -175.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.726 ' H ' ' HE1' ' A' ' 86' ' ' MET . 5.5 m-20 -76.66 151.22 36.24 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.4 OUTLIER -71.11 -32.69 69.34 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.151 -168.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.26 -28.63 65.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.848 174.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.726 ' HE1' ' H ' ' A' ' 83' ' ' ASP . 20.1 mtm -88.24 -41.59 12.84 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.543 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -58.82 -39.24 80.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.442 171.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -74.85 -27.16 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 122.642 0.377 . . . . 0.0 111.776 -175.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.502 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.0 pt20 -80.99 -22.81 39.18 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.589 172.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -83.42 -42.19 17.25 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.911 -179.149 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 87' ' ' ALA . 18.6 m -57.59 -32.47 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -45.12 95.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.158 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.69 HG23 ' SG ' ' A' ' 117' ' ' CYS . 3.3 mm -65.84 -44.16 92.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.53 174.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.5 mt -52.72 -47.8 50.04 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.771 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -70.19 -34.75 73.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.424 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.52 -52.36 3.98 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.59 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.6 m -72.29 -32.19 66.39 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.924 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HB2' HG13 ' A' ' 114' ' ' VAL . 34.0 tt0 -67.86 -38.41 83.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.959 0.8 . . . . 0.0 110.411 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.62 -43.54 89.24 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.941 0.4 . . . . 0.0 110.49 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -96.01 16.99 16.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.046 -176.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.39 151.42 91.93 Favored Pre-proline 0 C--N 1.325 -0.48 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 104' ' ' ASN . 52.5 Cg_exo -53.51 156.64 10.85 Favored 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 122.779 2.319 . . . . 0.0 112.156 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.07 24.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.062 2.508 . . . . 0.0 113.265 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 102' ' ' PRO . 67.5 m-20 -90.17 93.91 9.55 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -80.94 96.55 7.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.05 -177.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.9 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 11.9 t70 -122.32 105.87 10.58 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -29.26 -58.49 0.15 Allowed 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.954 1.409 . . . . 0.0 114.116 -177.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.8 t -93.98 -12.69 28.16 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.89 -0.506 . . . . 0.0 112.246 -173.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.9 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.3 ttt -85.7 -27.62 25.19 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.777 0.799 . . . . 0.0 111.617 -169.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -39.15 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.257 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -16.82 9.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.685 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.578 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.8 mp -87.73 -36.0 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.767 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 14.5 t70 -58.86 -36.2 74.22 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.781 177.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.466 HG13 ' HB2' ' A' ' 98' ' ' GLU . 8.5 m -80.21 -38.35 18.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 O-C-N 121.919 -0.488 . . . . 0.0 110.758 177.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.89 -46.92 88.71 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.864 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.767 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -73.18 -21.02 60.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.775 178.219 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.69 ' SG ' HG23 ' A' ' 93' ' ' ILE . 11.2 t -66.92 -28.68 68.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 0.0 109.804 171.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -81.04 -48.16 12.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.916 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.751 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.1 -29.25 66.17 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 118.473 -1.291 . . . . 0.0 110.404 -179.873 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' A' ' 116' ' ' MET . 11.0 ttmt -55.4 -54.85 38.63 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.24 170.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 19.9 mm-40 -57.76 -51.59 68.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.609 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.426 HG22 ' N ' ' A' ' 123' ' ' HIS . 1.8 tt -59.33 -33.16 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 118.034 0.379 . . . . 0.0 111.53 -179.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.426 ' N ' HG22 ' A' ' 122' ' ' ILE . 3.4 m-70 -71.96 -30.72 65.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.314 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -74.13 -35.84 64.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.072 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.578 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 96.9 Cg_endo . . . . . 0 N--CA 1.462 -0.351 0 N-CA-C 113.206 0.425 . . . . 0.0 113.206 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -50.11 -69.2 0.12 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.622 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.6 tp -73.45 -10.89 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.38 0.609 . . . . 0.0 111.101 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.578 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 77.0 mtp -79.31 -21.71 45.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.552 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.731 ' HZ3' ' HB2' ' A' ' 6' ' ' LYS . 4.7 ttmp? -81.1 80.98 7.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.203 0.525 . . . . 0.0 109.601 177.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -62.12 134.09 56.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.356 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.0 mp -54.9 -45.86 74.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.807 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -63.9 -32.63 74.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.84 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -74.98 -35.97 62.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.147 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.93 -45.91 69.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.02 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -46.76 -77.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.565 170.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.09 38.66 32.53 Favored Glycine 0 C--N 1.342 0.884 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.173 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -63.81 -55.56 22.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.021 0.439 . . . . 0.0 110.613 -177.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.5 105.37 4.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -70.52 -37.15 74.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.711 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.74 -28.74 69.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.511 -178.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -88.66 -27.18 21.44 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.226 -173.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 t -74.51 -35.02 63.17 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 1.0 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -59.32 -51.28 70.63 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.425 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -73.76 -32.31 63.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.406 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.16 -44.82 75.1 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.633 0.254 . . . . 0.0 110.844 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.601 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 10.5 mt -83.43 -17.29 42.65 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.042 0.449 . . . . 0.0 110.677 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.0 t 66.05 37.97 5.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.587 -177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 1.0 HD22 ' HA ' ' A' ' 20' ' ' LYS . 2.2 mm? -51.04 135.75 28.72 Favored Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.139 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.9 Cg_exo -65.28 149.65 88.25 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.909 1.739 . . . . 0.0 109.504 166.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -60.13 -32.66 71.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.673 0.273 . . . . 0.0 111.017 -174.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 t -70.01 -40.54 75.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.907 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 43.7 t -71.44 -53.14 21.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.392 -176.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.681 HG22 ' HG2' ' A' ' 20' ' ' LYS . 9.9 p -60.34 -36.51 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.804 -178.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.535 ' N ' HG12 ' A' ' 30' ' ' VAL . . . -66.34 -51.52 56.4 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.205 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -37.85 88.94 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.229 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.5 tp -54.36 -56.62 16.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.796 173.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -68.97 11.66 0.19 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -59.13 130.55 47.51 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 119.926 1.239 . . . . 0.0 110.12 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -70.34 -35.02 73.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.794 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -84.44 136.98 33.62 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.552 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 3.3 mptp? -85.24 75.21 10.31 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.891 -171.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.486 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 17.4 t70 -44.04 -55.38 4.73 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.291 172.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.9 t70 75.28 35.5 0.57 Allowed 'General case' 0 C--N 1.348 0.529 0 CA-C-O 121.899 0.857 . . . . 0.0 110.386 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.486 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -77.67 178.01 7.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.828 175.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.9 t -84.61 114.8 25.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 174.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.7 ttm -66.71 102.22 0.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.833 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -99.44 -34.8 10.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.104 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.88 117.32 11.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.928 0.87 . . . . 0.0 110.791 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.729 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -47.94 -36.91 13.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.695 -1.593 . . . . 0.0 112.718 174.439 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.703 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.3 mm? -68.5 -20.25 64.57 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.533 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.68 -55.6 4.72 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.27 -43.15 1.4 Allowed Glycine 0 CA--C 1.534 1.232 0 CA-C-N 115.021 -0.99 . . . . 0.0 114.629 167.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.417 ' HB3' HD12 ' A' ' 23' ' ' LEU . 3.2 m -79.61 -43.96 21.89 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.656 1.228 . . . . 0.0 112.174 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.575 ' HB1' HD13 ' A' ' 25' ' ' LEU . . . -71.08 -23.45 62.12 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 tp -73.12 -25.2 21.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.943 0.401 . . . . 0.0 110.305 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.5 43.63 3.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.24 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 30.7 p -94.55 -44.51 7.82 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.58 -177.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -46.86 88.93 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -171.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.77 -12.27 59.79 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.228 -174.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.561 HG21 ' CG1' ' A' ' 61' ' ' VAL . 89.4 m -83.75 -33.83 24.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.482 174.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 18.6 mmmt -75.08 -23.93 58.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.636 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.96 -65.14 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.054 174.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -177.41 116.68 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 -178.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.561 ' CG1' HG21 ' A' ' 57' ' ' THR . 12.7 p -167.3 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 122.133 0.968 . . . . 0.0 110.113 -177.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.646 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.3 m -107.59 116.89 52.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.419 -177.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -55.08 5.39 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.301 177.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.613 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 1.2 Cg_endo -91.17 -147.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.078 2.519 . . . . 0.0 112.605 -175.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -74.35 2.76 8.61 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -173.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 148.19 -61.35 0.44 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.303 -177.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.613 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 0.3 OUTLIER -87.87 164.17 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.509 -178.475 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.535 ' O ' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER 69.07 28.69 4.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 173.171 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.646 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.0 p80 -80.3 67.87 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.809 -0.557 . . . . 0.0 111.648 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -87.57 -48.43 7.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 110.085 176.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.54 -51.98 54.58 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.153 -176.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.42 -32.7 71.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.716 -0.242 . . . . 0.0 111.3 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.477 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -64.88 -36.07 83.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.629 ' HB3' ' HZ3' ' A' ' 74' ' ' LYS . 4.4 mmmp? -79.74 -36.35 37.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.449 178.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.493 ' HA ' ' HE3' ' A' ' 78' ' ' MET . 15.2 t70 -65.03 -40.96 95.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.345 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -63.57 -37.2 86.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.165 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -34.36 73.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.241 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.494 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.8 mtm -74.4 -35.78 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.13 -9.21 46.38 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.52 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.506 ' HB3' HD21 ' A' ' 8' ' ' LEU . 57.1 m-70 -141.07 89.27 2.23 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.687 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.19 -75.12 0.36 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.864 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.96 142.88 28.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.952 0.406 . . . . 0.0 111.63 -174.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.589 ' OD2' HG21 ' A' ' 85' ' ' THR . 2.3 p-10 -77.95 159.54 28.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 170.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -42.31 98.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.132 -162.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.589 HG21 ' OD2' ' A' ' 83' ' ' ASP . 1.6 t -54.13 -27.92 36.45 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.85 177.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.63 ' HA ' ' HG2' ' A' ' 89' ' ' GLN . 75.7 mtp -85.28 -39.58 17.56 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.449 0.642 . . . . 0.0 109.909 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.659 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -65.78 -31.83 73.03 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.947 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.477 ' O ' HG21 ' A' ' 91' ' ' VAL . 2.8 mp0 -82.24 -26.39 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.051 -176.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.63 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 26.1 pt20 -78.22 -22.89 47.81 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.6 tp -75.01 -47.25 30.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.974 175.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 87' ' ' ALA . 32.0 m -57.9 -35.81 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 120.857 0.361 . . . . 0.0 111.44 -176.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -62.69 -43.93 97.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.521 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.565 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.28 -42.71 84.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.19 176.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 55.9 mt -56.01 -48.14 79.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.122 0.487 . . . . 0.0 110.457 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.961 -175.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.56 -44.88 6.31 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.052 -172.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.565 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.9 m -73.09 -41.7 63.79 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 119.321 -0.371 . . . . 0.0 111.35 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.38 -29.48 69.66 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.982 173.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -63.71 -39.82 95.25 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.219 0.533 . . . . 0.0 109.951 173.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.7 m -99.58 15.93 24.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.001 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.45 147.73 75.99 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.272 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.432 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 70.3 Cg_exo -52.79 151.89 18.63 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.257 2.638 . . . . 0.0 112.606 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 13.9 Cg_exo -70.84 47.1 0.69 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.719 2.946 . . . . 0.0 112.907 -179.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -125.57 94.3 4.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.369 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -81.54 96.5 7.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.101 0.476 . . . . 0.0 111.74 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.513 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 11.6 t70 -112.84 113.81 26.06 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 168.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.608 ' HG2' ' H ' ' A' ' 108' ' ' CYS . 0.9 OUTLIER -33.63 -60.55 0.36 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.608 ' H ' ' HG2' ' A' ' 107' ' ' LYS . 5.9 t -91.19 -12.08 36.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.824 0.738 . . . . 0.0 112.16 -175.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.667 ' HG3' ' HB3' ' A' ' 46' ' ' ARG . 2.9 ttp -81.29 -29.96 34.13 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-O 122.025 0.917 . . . . 0.0 111.525 -171.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -39.11 78.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.565 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.515 ' O ' ' HB1' ' A' ' 115' ' ' ALA . 0.3 OUTLIER -55.96 -15.81 3.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.508 -1.224 . . . . 0.0 112.428 174.552 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.522 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -90.69 -38.57 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.702 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 0.3 OUTLIER -58.31 -38.26 76.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.056 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -80.86 -35.92 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.525 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.515 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -61.55 -48.31 81.58 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.702 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -73.52 -19.91 60.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.608 0.718 . . . . 0.0 110.48 178.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.685 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 9.0 t -72.74 -26.4 61.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.583 172.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.417 ' HB2' HG22 ' A' ' 93' ' ' ILE . 87.7 t80 -80.3 -44.0 20.32 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.54 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.671 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.48 -28.07 65.76 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.834 179.064 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.685 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -61.32 -50.15 74.11 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 171.132 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 124' ' ' LYS . 0.4 OUTLIER -59.18 -47.91 83.56 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 173.005 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.671 HG23 ' HA ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -55.75 -35.7 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 118.18 0.446 . . . . 0.0 111.266 178.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.529 ' N ' HG22 ' A' ' 122' ' ' ILE . 9.5 m170 -70.9 -32.0 68.82 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.82 0.343 . . . . 0.0 111.01 177.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 121' ' ' GLU . 68.3 tttt -66.21 -28.29 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.262 176.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 CA--C 1.536 0.415 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.164 175.783 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.732 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.6 Cg_exo . . . . . 0 N--CA 1.477 0.542 0 N-CA-C 114.377 0.876 . . . . 0.0 114.377 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.8 mp0 -45.68 -69.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.485 0.491 . . . . 0.0 111.341 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.518 HD11 ' HB2' ' A' ' 82' ' ' ALA . 7.6 tp -87.26 -9.48 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.709 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' MET . . . . . 0.732 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 17.4 tmm? -65.48 -36.17 83.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.923 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.62 ' HB3' ' HZ3' ' A' ' 6' ' ' LYS . 8.8 mtpm? -86.51 97.45 10.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.025 0.44 . . . . 0.0 110.212 177.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -67.36 140.68 57.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.141 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mp -58.82 -38.98 79.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.052 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -58.51 -35.84 72.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.969 0.414 . . . . 0.0 110.805 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -75.39 -33.73 61.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.526 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -68.87 -56.59 7.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.318 176.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -52.19 -77.3 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 176.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.55 36.93 59.52 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.564 -170.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -84.97 -40.45 16.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.048 0.452 . . . . 0.0 110.666 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.48 59.43 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.688 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' MET . . . . . 0.64 ' HE2' ' HH ' ' A' ' 34' ' ' TYR . 16.1 tpt -70.11 -39.71 75.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.196 0.522 . . . . 0.0 110.263 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -61.2 -30.14 70.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.809 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -88.78 -20.52 24.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.01 -0.676 . . . . 0.0 111.919 -174.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -75.21 -32.55 61.22 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 168.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.941 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 26.2 tptp -61.32 -47.92 83.74 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.443 175.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -72.77 -38.16 67.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.802 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -61.12 -41.71 97.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.895 0.378 . . . . 0.0 110.79 -176.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.551 ' HB3' HD11 ' A' ' 47' ' ' LEU . 12.9 mt -86.6 -10.89 52.95 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.722 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t 57.55 41.68 25.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.55 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.941 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 16.2 mt -51.28 119.82 13.34 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.878 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.649 ' HD3' HD23 ' A' ' 47' ' ' LEU . 13.7 Cg_exo -72.24 157.94 52.77 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.751 2.301 . . . . 0.0 110.815 171.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.537 ' HA ' HG23 ' A' ' 30' ' ' VAL . 7.7 p-10 -65.17 -27.22 68.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -175.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.1 m -68.82 -39.64 79.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.902 0.382 . . . . 0.0 110.516 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.788 HG22 HD21 ' A' ' 47' ' ' LEU . 58.0 t -72.33 -44.52 63.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 27' ' ' ASP . 11.1 m -59.87 -31.7 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 110.566 175.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.65 -52.12 58.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.948 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -67.34 -36.37 81.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.32 -56.93 13.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.365 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.64 ' HH ' ' HE2' ' A' ' 16' ' ' MET . 41.4 m-85 -69.04 10.56 0.28 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -66.27 103.81 1.07 Allowed 'General case' 0 C--N 1.344 0.344 0 CA-C-N 120.108 1.322 . . . . 0.0 110.178 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -71.0 -32.37 69.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.109 -175.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -90.23 101.9 14.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.586 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.623 ' HB2' ' HZ1' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -72.64 79.69 1.09 Allowed 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.599 0.714 . . . . 0.0 110.443 179.248 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.81 12.89 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.49 -1.232 . . . . 0.0 114.056 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.0 t70 60.02 70.89 0.6 Allowed 'General case' 0 C--N 1.343 0.321 0 CA-C-N 118.695 0.68 . . . . 0.0 110.176 -168.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -115.52 176.35 5.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.762 177.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.7 t -108.89 121.62 62.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.1 ttm -77.68 100.65 6.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.4 p -94.21 -29.92 14.85 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.165 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -78.0 115.06 17.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.677 0.751 . . . . 0.0 110.13 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.882 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -57.27 -35.2 69.48 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.921 174.527 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.788 HD21 HG22 ' A' ' 29' ' ' VAL . 56.5 tp -64.92 -17.81 64.67 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 120.978 0.418 . . . . 0.0 110.795 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.67 1.8 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.03 -45.66 2.24 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 115.215 -0.902 . . . . 0.0 114.672 166.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 86.7 m -64.33 -42.64 96.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.307 1.053 . . . . 0.0 110.408 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.85 -25.11 67.76 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.646 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.1 mt -73.35 -35.57 46.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.188 0.518 . . . . 0.0 110.164 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -104.75 44.74 1.0 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.431 -175.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t -112.27 -47.95 3.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.94 -52.06 58.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.34 0.59 . . . . 0.0 111.037 -170.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.92 -11.58 59.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.273 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.626 ' HA ' HG12 ' A' ' 61' ' ' VAL . 22.5 m -83.36 -35.25 25.28 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.525 175.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -78.1 -17.35 57.04 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.405 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mt -64.91 -66.96 0.48 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.57 172.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -178.29 121.75 0.1 Allowed 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 57' ' ' THR . 11.9 p -176.63 34.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.906 0.86 . . . . 0.0 111.082 -175.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.529 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 33.6 m -108.52 115.5 49.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 O-C-N 121.158 -0.964 . . . . 0.0 111.422 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.22 -55.84 2.11 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.009 178.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.568 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 15.9 Cg_endo -97.47 -140.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.984 2.456 . . . . 0.0 113.165 -171.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.434 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 16.4 m-20 -72.89 6.71 2.41 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.48 -174.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.17 -75.35 0.43 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.69 HD21 HD23 ' A' ' 68' ' ' LEU . 3.0 p-10 -69.52 153.76 43.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.939 -0.63 . . . . 0.0 111.039 176.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.69 HD23 HD21 ' A' ' 67' ' ' ASN . 4.2 mm? 69.82 32.87 3.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.587 173.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.529 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.5 p-80 -73.73 76.28 1.56 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.388 0.613 . . . . 0.0 110.71 171.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -86.39 -59.12 2.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.699 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.7 -52.36 53.52 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.216 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -58.13 -34.4 70.21 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.832 -0.184 . . . . 0.0 111.458 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.597 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -67.83 -36.45 80.37 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.3 0.572 . . . . 0.0 111.184 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.565 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.5 mmmt -80.03 -37.66 33.61 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.61 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.28 -40.6 96.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.27 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -61.49 -40.56 95.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.45 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.28 73.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.96 0.41 . . . . 0.0 111.179 -178.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.62 ' HE1' ' HB3' ' A' ' 87' ' ' ALA . 53.0 mtt -74.34 -23.7 59.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.088 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -85.88 -15.49 41.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.732 -176.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -146.89 96.71 2.79 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.076 -176.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.54 -71.47 0.22 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.379 -0.915 . . . . 0.0 112.658 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -85.06 139.99 31.33 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.487 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.534 ' OD2' HG21 ' A' ' 85' ' ' THR . 0.3 OUTLIER -84.04 166.18 17.94 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.361 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.595 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.46 -25.61 63.26 Favored 'General case' 0 N--CA 1.416 -2.168 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.414 -167.564 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.766 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.6 OUTLIER -73.87 -31.11 63.0 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.121 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 9.3 tpp -78.54 -48.0 16.14 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.82 0.819 . . . . 0.0 108.946 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.62 ' HB3' ' HE1' ' A' ' 78' ' ' MET . . . -58.73 -36.7 74.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.409 176.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.738 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.14 -25.66 61.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.91 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.766 ' HG2' ' O ' ' A' ' 85' ' ' THR . 14.2 mm-40 -77.77 -25.3 49.0 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.5 tt -87.89 -43.62 11.66 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.862 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' A' ' 88' ' ' GLN . 4.8 m -60.9 -27.89 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -66.47 -41.14 89.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.462 0.649 . . . . 0.0 109.861 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.586 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -66.46 -39.34 83.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 176.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 91' ' ' VAL . 49.3 mt -57.99 -47.39 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.146 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -69.71 -34.88 74.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.55 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.22 -53.09 3.77 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.058 -1.068 . . . . 0.0 112.515 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.7 m -72.42 -32.18 66.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.521 ' OE2' ' HE2' ' A' ' 110' ' ' LYS . 40.3 tt0 -67.21 -34.72 78.08 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.122 0.874 . . . . 0.0 110.114 173.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -63.67 -41.2 98.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.923 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.1 m -103.06 19.57 19.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.72 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.41 155.7 83.72 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.902 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.456 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 71.9 Cg_exo -48.41 135.84 26.01 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.692 2.261 . . . . 0.0 111.636 174.568 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.2 Cg_exo -70.51 49.32 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 123.686 2.924 . . . . 0.0 113.498 -176.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -125.35 94.37 4.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 173.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.408 ' CG ' ' HZ3' ' A' ' 110' ' ' LYS . 2.5 t70 -81.13 84.96 6.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.087 -171.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.7 t70 -106.94 133.47 51.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.587 176.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -30.05 -75.28 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.712 1.258 . . . . 0.0 113.711 -175.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.882 ' HB2' ' HB2' ' A' ' 46' ' ' ARG . 98.1 m -88.63 -10.29 49.13 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.652 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -69.61 -41.17 76.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 -173.557 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.521 ' HE2' ' OE2' ' A' ' 98' ' ' GLU . 14.3 ptmt -65.19 -51.0 63.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.778 0.799 . . . . 0.0 110.373 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.482 ' HA ' HG21 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -59.56 -14.27 12.49 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.575 174.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.466 HD11 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -87.59 -36.31 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 177.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -63.42 -35.26 79.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.356 176.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.532 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 16.0 m -76.36 -37.08 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.985 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.21 78.5 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.308 0.575 . . . . 0.0 111.367 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.604 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.2 ptt? -69.09 -17.68 63.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.281 178.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.586 ' SG ' HG23 ' A' ' 93' ' ' ILE . 31.8 t -73.54 -30.03 62.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.835 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -77.64 -43.23 32.12 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.585 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.652 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -70.42 -23.42 62.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.903 176.576 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.604 ' HE3' ' O ' ' A' ' 116' ' ' MET . 1.1 ttmt -62.23 -48.29 80.63 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 121.353 -0.842 . . . . 0.0 110.095 170.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -59.14 -45.0 92.09 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.652 HG23 ' HA ' ' A' ' 119' ' ' LYS . 11.8 tt -58.92 -33.41 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-N 118.799 0.727 . . . . 0.0 110.675 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.566 ' N ' HG22 ' A' ' 122' ' ' ILE . 9.8 m170 -71.1 -31.43 67.79 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.448 174.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -66.39 -35.28 79.93 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.527 0.331 . . . . 0.0 111.552 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' A' ' 122' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo . . . . . 0 N--CA 1.462 -0.366 0 CA-C-O 120.683 0.201 . . . . 0.0 112.402 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -45.17 -68.11 0.23 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.173 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.0 tt -83.14 -9.62 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-O 121.002 0.429 . . . . 0.0 111.433 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.2 mmm -66.64 -26.02 66.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.203 0.525 . . . . 0.0 109.799 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -92.93 102.47 14.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.234 166.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -62.92 130.05 43.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 110.888 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 89.6 mt -65.18 -45.04 86.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.598 -176.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 m -60.5 -40.57 91.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.769 0.319 . . . . 0.0 110.771 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -75.89 -24.25 55.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.083 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . 0.456 ' C ' HD21 ' A' ' 11' ' ' ASN . 0.2 OUTLIER -73.43 -50.79 19.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 175.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 34.9 m-85 -50.24 -77.99 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.353 173.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.44 38.52 62.89 Favored Glycine 0 C--N 1.343 0.954 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.717 -177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -68.12 -36.79 80.29 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 117.295 0.547 . . . . 0.0 110.512 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.29 101.52 3.13 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.629 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 50.9 ttm -70.15 -34.43 73.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.105 0.479 . . . . 0.0 109.805 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.35 -38.73 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.279 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -88.29 -25.99 22.51 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.644 -172.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t -75.53 -35.5 60.71 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -47.94 81.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.883 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.73 -37.31 41.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.832 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.534 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 33.9 tp10 -61.45 -41.47 97.26 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.348 0.118 . . . . 0.0 111.025 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.525 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 mm? -79.05 -22.48 45.3 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.325 172.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.2 m 58.44 50.54 9.23 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -170.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.657 HD23 HG13 ' A' ' 29' ' ' VAL . 25.4 mt -66.56 121.5 77.49 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.969 -171.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.556 ' HD2' ' CG2' ' A' ' 29' ' ' VAL . 11.8 Cg_exo -73.3 154.82 51.5 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.558 2.172 . . . . 0.0 110.841 171.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.621 ' HA ' HG23 ' A' ' 30' ' ' VAL . 6.0 p-10 -63.54 -23.6 67.46 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 m -65.79 -39.05 90.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.423 0.63 . . . . 0.0 109.85 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.657 HG13 HD23 ' A' ' 25' ' ' LEU . 58.9 t -70.57 -51.79 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.483 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.621 HG23 ' HA ' ' A' ' 27' ' ' ASP . 16.9 m -57.68 -30.51 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.167 0.508 . . . . 0.0 110.731 179.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.86 -52.23 57.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.63 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.71 -35.68 65.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.804 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 19.3 tp -50.53 -55.46 15.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.793 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.419 ' HD1' ' O ' ' A' ' 30' ' ' VAL . 20.4 m-85 -77.41 11.45 1.97 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -175.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -58.85 111.39 1.27 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 118.28 0.491 . . . . 0.0 109.873 176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -79.05 -17.33 55.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.513 -171.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -91.03 124.71 35.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.633 0.254 . . . . 0.0 110.897 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -75.96 65.46 2.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.736 179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.705 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 36.5 t70 -54.89 -19.09 5.84 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.771 1.767 . . . . 0.0 115.771 178.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.9 t70 62.63 70.61 0.55 Allowed 'General case' 0 C--N 1.348 0.517 0 CA-C-N 119.717 1.144 . . . . 0.0 109.59 -169.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.705 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.0 p90 -114.75 165.77 12.46 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.375 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.32 117.31 31.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.5 ttm -75.1 102.05 4.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.364 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -107.43 -16.69 14.31 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -77.98 130.94 37.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.479 . . . . 0.0 110.289 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.864 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 3.4 mpt_? -69.99 -27.07 64.41 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.297 -171.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.636 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.7 mm? -80.42 -15.73 56.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.053 -173.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.411 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.34 -61.12 2.03 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.0 -47.69 1.92 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.073 168.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 m -70.79 -42.5 70.26 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.448 1.124 . . . . 0.0 112.042 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.19 -6.28 38.33 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -177.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 48' ' ' ALA . 45.3 mm -57.02 -30.22 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.142 0.496 . . . . 0.0 110.151 172.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . 0.538 ' N ' HD21 ' A' ' 53' ' ' ASN . 0.0 OUTLIER -145.49 86.14 1.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.162 -179.106 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' CYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.0 p -112.72 -47.93 3.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -177.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.426 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 52.7 tp -64.53 -55.41 20.74 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.076 0.465 . . . . 0.0 112.083 -170.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.29 -13.79 58.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.958 0.408 . . . . 0.0 110.268 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.647 HG21 HG12 ' A' ' 61' ' ' VAL . 30.5 m -74.54 -34.85 63.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.493 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.534 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 17.5 mmmt -81.17 -24.72 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.222 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 66.5 mt -64.74 -61.81 1.96 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.135 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -175.09 112.78 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.545 0.212 . . . . 0.0 110.802 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.647 HG12 HG21 ' A' ' 57' ' ' THR . 9.2 p -170.3 32.24 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 121.969 0.89 . . . . 0.0 110.091 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.539 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 19.2 m -105.25 120.49 56.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 O-C-N 121.808 -0.557 . . . . 0.0 110.926 -175.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -75.39 -55.51 2.12 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.674 175.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' PRO . . . . . 0.654 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.5 Cg_endo -97.26 -143.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 123.112 2.541 . . . . 0.0 113.071 -172.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -72.22 -1.34 14.78 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.593 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 144.14 -68.84 0.42 Allowed Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.164 -0.774 . . . . 0.0 111.164 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . 0.654 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -75.35 149.76 38.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.885 -0.657 . . . . 0.0 111.202 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.588 HD23 HD21 ' A' ' 67' ' ' ASN . 4.5 mm? 69.28 37.66 2.03 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.017 172.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.563 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.3 p80 -72.6 80.63 1.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.304 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.547 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 28.6 p-80 -87.39 -59.82 2.14 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.8 -63.48 4.58 Favored Glycine 0 N--CA 1.462 0.368 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.296 -170.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -57.47 -24.62 56.85 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -177.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.451 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -74.37 -36.07 63.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.435 0.636 . . . . 0.0 111.144 178.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.624 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.1 mmmt -79.48 -33.63 42.06 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.71 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.578 172.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 87.7 t80 -57.28 -37.11 71.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.354 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.89 75.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.858 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 54.1 mtt -66.86 -36.24 81.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.901 -175.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -87.63 -14.92 38.73 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.111 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -136.65 89.57 2.47 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.021 -175.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.1 -62.04 0.3 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.077 -1.058 . . . . 0.0 112.361 171.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.95 132.16 35.98 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 121.134 0.492 . . . . 0.0 110.833 -177.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.853 ' H ' ' HE3' ' A' ' 86' ' ' MET . 91.5 m-20 -75.01 149.42 39.27 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.97 -33.52 64.87 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.884 -174.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.39 -26.4 60.08 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 122.344 -0.223 . . . . 0.0 110.94 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' MET . . . . . 0.853 ' HE3' ' H ' ' A' ' 83' ' ' ASP . 17.9 mtm -86.38 -38.48 17.36 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -174.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . 0.491 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -63.73 -42.6 97.88 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.883 175.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -75.58 -25.61 57.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -176.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.97 -23.89 44.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.607 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.626 ' HG ' HD12 ' A' ' 94' ' ' ILE . 60.0 tp -86.51 -48.17 8.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.244 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 16.8 m -57.69 -36.34 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.307 -174.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.02 -42.05 97.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.974 0.416 . . . . 0.0 110.091 -177.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.709 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mm -65.79 -42.34 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.896 175.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.626 HD12 ' HG ' ' A' ' 90' ' ' LEU . 58.5 mt -55.43 -47.42 78.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.965 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -70.06 -34.29 73.03 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.439 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -44.07 7.06 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.301 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 0.744 ' HB2' HG12 ' A' ' 114' ' ' VAL . 68.6 m -72.56 -34.4 67.46 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.472 ' HG3' ' CG1' ' A' ' 114' ' ' VAL . 8.3 mt-10 -64.52 -37.54 87.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.436 0.562 . . . . 0.0 111.069 170.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -67.38 -41.88 84.32 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.821 0.343 . . . . 0.0 110.512 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.4 m -94.68 14.41 21.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.924 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -80.76 150.43 69.44 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.91 159.94 50.97 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 122.606 2.204 . . . . 0.0 110.567 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.12 84.77 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.337 2.024 . . . . 0.0 111.232 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -126.29 108.81 11.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.992 -176.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -83.37 26.69 0.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -169.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.45 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 2.8 p30 -89.73 105.29 17.71 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 122.467 1.127 . . . . 0.0 111.642 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.5 tttp -29.28 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 114.674 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -84.61 -9.97 57.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.659 0.266 . . . . 0.0 111.525 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.864 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 91.7 mmm -85.12 -21.37 29.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -172.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.564 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -57.69 -45.31 85.83 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 122.095 0.95 . . . . 0.0 109.975 177.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.564 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.38 -12.49 3.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.261 174.227 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . 0.506 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.3 mp -89.52 -38.85 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . 0.58 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 13.8 m-20 -60.67 -36.94 79.99 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.767 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' A' ' 97' ' ' CYS . 10.9 m -76.77 -38.21 29.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.91 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.06 -49.08 77.39 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 121.448 0.642 . . . . 0.0 111.546 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' MET . . . . . 0.668 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.13 -23.46 63.97 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.766 179.034 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' CYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 9.3 t -69.43 -26.74 64.75 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 123.344 0.658 . . . . 0.0 109.529 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -75.3 -46.92 30.43 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.262 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 -25.63 65.02 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 118.345 -1.342 . . . . 0.0 111.15 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' LYS . . . . . 0.668 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.37 -56.56 18.75 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 109.878 168.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 20.4 mm-40 -59.94 -42.73 94.66 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.507 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.452 HG22 ' HD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -56.52 -34.19 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 118.126 0.421 . . . . 0.0 111.351 177.235 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' HIS . . . . . 0.452 ' HD2' HG22 ' A' ' 122' ' ' ILE . 12.2 m170 -72.19 -31.93 66.34 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.088 -0.383 . . . . 0.0 111.39 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -69.53 -30.54 68.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.269 0.556 . . . . 0.0 110.419 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 97.8 mt . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.202 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.8 p . . . . . 0 N--CA 1.481 1.109 0 CA-C-O 120.371 0.129 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.557 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.9 Cg_endo -65.65 -21.28 59.26 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.817 2.345 . . . . 0.0 112.855 -177.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.01 -69.07 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.568 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.446 HD12 ' HA ' ' A' ' 4' ' ' ILE . 6.6 tp -80.61 -9.71 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 121.132 0.491 . . . . 0.0 111.638 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.557 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 78.4 mtp -73.98 -21.18 60.09 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.47 176.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -74.1 91.68 2.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -73.04 131.84 42.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.52 -174.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 71.6 mt -55.99 -47.49 77.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.124 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.609 ' HB3' HD21 ' A' ' 55' ' ' LEU . 49.2 m -61.89 -29.97 70.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.438 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -75.27 -36.04 61.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.422 . . . . 0.0 110.295 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -68.71 -52.65 28.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.985 178.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -51.41 -78.01 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 173.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.411 ' HA2' ' HE3' ' A' ' 16' ' ' MET . . . 55.5 35.49 61.74 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.631 -175.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -75.65 -41.17 54.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.071 0.436 . . . . 0.0 111.42 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.91 99.36 3.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.861 0.362 . . . . 0.0 111.227 -173.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.411 ' HE3' ' HA2' ' A' ' 13' ' ' GLY . 0.0 OUTLIER -81.33 -46.68 14.35 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.255 -178.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.07 -30.74 71.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.948 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -87.82 -21.99 24.74 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.727 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.2 t -75.21 -34.97 61.53 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 167.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.794 ' HA ' HD12 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -61.16 -45.58 94.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.897 178.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -71.16 -40.37 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.788 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.645 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 30.6 tp10 -60.09 -44.07 95.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.373 -0.131 . . . . 0.0 111.042 -173.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.716 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.4 mt -88.44 -8.58 54.7 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.496 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.5 m 57.68 37.57 27.36 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.133 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.794 HD12 ' HA ' ' A' ' 20' ' ' LYS . 5.0 mp -54.08 121.53 30.62 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.293 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.96 155.4 68.24 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.191 1.927 . . . . 0.0 110.878 172.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.68 -31.98 71.21 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.7 p -63.8 -40.4 96.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.707 0.289 . . . . 0.0 111.444 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.5 t -76.21 -55.73 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.643 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -59.61 -28.79 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.935 0.398 . . . . 0.0 110.865 -176.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.56 -51.43 35.49 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.29 -35.98 82.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.318 0.58 . . . . 0.0 110.031 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -38.62 69.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.395 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -78.54 8.9 4.53 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.474 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 43.7 t30 -65.65 107.74 1.84 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.709 0.686 . . . . 0.0 109.747 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -81.16 -18.38 46.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.227 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.474 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 30.4 m-90 -73.45 131.71 42.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -80.71 53.29 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.125 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.558 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 37.7 t70 -43.73 -42.67 5.55 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 172.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.4 t70 66.36 61.31 0.59 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-O 121.716 0.769 . . . . 0.0 109.929 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.558 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -97.28 177.32 5.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.107 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.2 t -84.29 126.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.74 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 37.5 ttm -67.11 103.46 1.2 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.0 p -101.72 -26.74 13.39 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -173.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.601 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 15.3 t70 -101.62 122.51 44.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.69 0.757 . . . . 0.0 112.493 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.988 ' HB2' ' HB3' ' A' ' 108' ' ' CYS . 0.1 OUTLIER -47.59 -40.94 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.132 172.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.811 HD22 ' HG2' ' A' ' 46' ' ' ARG . 2.9 mm? -65.87 -19.24 65.81 Favored 'General case' 0 C--N 1.333 -0.144 0 O-C-N 122.021 -0.425 . . . . 0.0 111.068 -176.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.08 -61.24 1.96 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.12 -48.13 2.65 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 114.688 -1.142 . . . . 0.0 114.504 168.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.5 m -67.31 -41.95 84.51 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.405 1.102 . . . . 0.0 111.674 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.478 ' HB1' HD21 ' A' ' 25' ' ' LEU . . . -63.24 -23.86 67.61 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.9 mt -58.09 -39.23 71.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.992 0.425 . . . . 0.0 110.946 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.499 ' O ' ' HB ' ' A' ' 57' ' ' THR . 3.7 p-10 -113.84 42.84 1.93 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.481 0.658 . . . . 0.0 110.16 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 10.6 t -98.75 -46.4 5.69 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.656 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.609 HD21 ' HB3' ' A' ' 9' ' ' SER . 4.4 mm? -60.31 -55.88 28.24 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 111.963 -174.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.09 -16.62 49.41 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.909 -172.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.499 ' HB ' ' O ' ' A' ' 53' ' ' ASN . 18.1 m -84.93 -42.37 15.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.372 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.645 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 5.8 mmmt -72.76 -15.97 61.65 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.373 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.84 -65.92 0.61 Allowed 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 172.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -176.28 119.14 0.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.056 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.481 ' CG1' HG21 ' A' ' 57' ' ' THR . 9.2 p -175.62 31.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 121.54 0.686 . . . . 0.0 111.327 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.522 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 32.9 m -93.34 118.72 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 O-C-N 121.147 -0.971 . . . . 0.0 111.401 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.31 -53.27 10.67 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.505 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.684 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -98.99 -143.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 123.345 2.696 . . . . 0.0 112.999 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 6.3 p-10 -72.21 -5.72 37.8 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.633 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 151.41 -60.96 0.41 Allowed Glycine 0 C--N 1.316 -0.572 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.684 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -85.36 165.48 17.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.815 -0.692 . . . . 0.0 109.817 176.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.09 29.79 4.62 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.308 0.575 . . . . 0.0 111.308 171.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.552 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 9.2 p80 -73.4 74.3 1.38 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.192 0.52 . . . . 0.0 111.794 177.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -86.38 -50.86 6.6 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.13 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.4 -61.71 6.58 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.948 -172.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -56.68 -31.08 64.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.67 -37.95 76.89 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.219 0.533 . . . . 0.0 110.968 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -79.73 -35.59 38.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.0 -40.96 95.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.457 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -63.57 -38.78 92.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.663 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.09 78.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.066 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.514 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 72.0 mtm -73.63 -23.46 59.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.812 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -93.22 -14.26 27.31 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.935 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -144.99 95.41 2.68 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 120.742 0.306 . . . . 0.0 111.042 -177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.38 -70.11 0.42 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.236 173.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -103.72 135.4 45.34 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.437 ' OD1' HG21 ' A' ' 85' ' ' THR . 1.0 OUTLIER -80.21 172.56 13.61 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.197 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -23.25 67.16 Favored 'General case' 0 N--CA 1.422 -1.872 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.604 -167.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.807 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 1.2 t -73.19 -30.9 63.86 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.481 -177.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.473 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 71.9 mtp -81.93 -41.2 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.376 0.608 . . . . 0.0 109.362 -175.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -62.29 -33.23 74.25 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.235 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.74 -21.45 51.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.25 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.807 ' HG2' ' O ' ' A' ' 85' ' ' THR . 10.6 mm-40 -77.74 -25.31 49.14 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 172.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.512 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.2 mp -85.45 -42.94 14.03 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.604 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 87' ' ' ALA . 29.8 m -56.91 -32.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.86 0.362 . . . . 0.0 111.809 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.17 -44.91 78.52 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.601 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.582 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.5 mp -67.62 -43.75 86.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 90' ' ' LEU . 50.0 mt -52.67 -48.7 48.16 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.786 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -71.7 -36.54 70.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.196 -174.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.33 -44.4 6.6 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 119.722 -1.228 . . . . 0.0 112.367 -172.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.742 ' HB2' HG12 ' A' ' 114' ' ' VAL . 38.7 m -72.23 -41.11 67.2 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.854 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -63.89 -38.79 92.4 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 117.948 0.34 . . . . 0.0 110.798 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -67.14 -34.46 77.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 m -95.79 5.34 51.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.259 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.33 149.44 78.91 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.719 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.468 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 22.7 Cg_exo -65.37 144.53 80.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.731 2.287 . . . . 0.0 111.195 178.009 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 7.9 Cg_exo -73.37 35.52 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.425 2.75 . . . . 0.0 113.314 -175.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -76.77 112.08 12.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -77.75 96.22 4.85 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -167.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.0 t0 -144.04 100.73 3.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 163.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -40.77 -44.75 2.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.988 ' HB3' ' HB2' ' A' ' 46' ' ' ARG . 4.1 t -88.06 -24.58 23.41 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.583 1.083 . . . . 0.0 112.232 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.736 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 75.4 mmm -74.76 -26.39 59.73 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.987 -0.445 . . . . 0.0 111.884 -175.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.555 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -60.14 -43.03 96.04 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.766 0.793 . . . . 0.0 110.032 178.192 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.555 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.03 -14.9 7.46 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.35 174.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.554 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.5 mp -89.95 -38.0 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.658 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 14.4 t70 -60.06 -34.11 72.97 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.432 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.742 HG12 ' HB2' ' A' ' 97' ' ' CYS . 14.0 m -80.57 -39.47 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.574 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.75 -49.64 76.68 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.323 0.582 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.711 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.84 -24.67 63.49 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.305 178.918 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.4 t -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.171 0.51 . . . . 0.0 110.137 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.58 ' HB2' HG22 ' A' ' 93' ' ' ILE . 73.7 t80 -79.65 -45.87 18.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.123 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -69.27 -28.8 66.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.71 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.711 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.54 -51.06 71.48 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.916 0.389 . . . . 0.0 110.452 170.349 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -57.52 -54.9 41.64 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.67 177.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.461 HD11 HG21 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -58.14 -32.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 120.699 0.285 . . . . 0.0 111.44 178.79 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -71.22 -30.63 66.59 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.615 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.28 -33.07 67.17 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.36 -40.05 89.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.56 172.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 64.3 t30 49.47 -85.03 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.531 1.133 . . . . 0.0 113.71 172.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -77.79 100.17 6.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.557 0.694 . . . . 0.0 111.656 -174.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.3 p -135.5 103.47 10.3 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.184 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.15 138.02 22.14 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.022 2.481 . . . . 0.0 112.302 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -90.41 151.64 21.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.053 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.94 -7.6 58.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.365 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 67.73 117.58 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.883 0.739 . . . . 0.0 111.593 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp -86.45 65.56 9.1 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.948 -177.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 11.9 m -76.23 107.79 7.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.566 0.698 . . . . 0.0 110.949 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.426 ' O ' HD11 ' A' ' 135' ' ' ILE . 0.0 OUTLIER -117.9 120.06 63.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.778 179.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -96.56 96.69 1.93 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.578 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -75.37 95.26 3.19 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.6 m -82.36 96.73 3.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.52 0.676 . . . . 0.0 111.505 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -95.22 103.13 14.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -100.61 107.2 18.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.43 . . . . 0.0 110.885 -177.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -77.09 147.64 36.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.47 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.422 ' O ' HG13 ' A' ' 142' ' ' VAL . 11.4 p . . . . . 0 C--O 1.248 0.989 0 O-C-N 124.473 1.108 . . . . 0.0 112.498 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.581 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 18.5 Cg_endo -57.99 -21.91 52.38 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.361 2.707 . . . . 0.0 114.384 -173.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.5 -69.13 0.12 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.72 0.295 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.71 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.2 mm -80.16 -15.08 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-O 121.092 0.472 . . . . 0.0 111.676 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.581 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 13.4 tmm? -64.64 -38.2 90.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.016 0.436 . . . . 0.0 110.267 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -93.45 120.38 33.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.36 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -71.79 133.83 45.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.789 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 80' ' ' HIS . 50.7 mt -57.7 -43.15 84.97 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.035 0.209 . . . . 0.0 110.914 178.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.0 m -61.79 -38.72 89.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.897 0.379 . . . . 0.0 110.763 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -75.47 -34.56 60.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.4 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -67.19 -54.05 24.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.678 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.434 ' HD2' ' O ' ' A' ' 8' ' ' LEU . 32.9 m-85 -47.45 -73.02 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.459 168.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.01 40.23 58.18 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.306 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' LYS . 12.2 tmtt? -67.48 -58.14 5.27 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.1 90.46 1.36 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.684 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 64.6 mtt -71.62 -27.19 62.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.251 0.548 . . . . 0.0 109.773 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.527 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 37.3 t70 -62.27 -24.69 67.42 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.799 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -88.13 -25.14 23.14 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.197 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.6 t -76.13 -36.58 58.74 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.76 -42.09 97.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.462 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -71.3 -42.85 68.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.088 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.535 ' CD ' ' HZ1' ' A' ' 58' ' ' LYS . 18.9 tt0 -70.24 -41.46 73.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.352 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.805 ' HB2' HD13 ' A' ' 25' ' ' LEU . 15.3 mt -83.48 1.17 43.1 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.972 0.415 . . . . 0.0 111.291 -177.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.8 m 67.38 31.92 6.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.721 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.805 HD13 ' HB2' ' A' ' 23' ' ' LEU . 8.4 mp -62.15 121.4 65.78 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.724 175.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -71.07 160.22 49.91 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.89 2.393 . . . . 0.0 111.167 173.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.758 ' HA ' HG23 ' A' ' 30' ' ' VAL . 4.6 p-10 -69.4 -16.42 63.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.34 -176.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 p -64.85 -48.83 72.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 0.0 110.341 174.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.2 t -71.0 -45.82 70.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.256 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.758 HG23 ' HA ' ' A' ' 27' ' ' ASP . 14.9 m -59.28 -30.04 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.975 0.417 . . . . 0.0 110.043 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.54 -52.19 54.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.798 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.02 -36.11 81.38 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.104 0.478 . . . . 0.0 110.202 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -54.99 25.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.177 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -66.95 11.08 0.11 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -64.36 118.27 8.46 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.02 1.282 . . . . 0.0 110.063 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -92.55 -36.33 13.09 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -77.39 151.18 34.94 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.217 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -80.13 60.24 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.951 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -55.49 -36.33 66.52 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.713 171.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.1 t0 59.41 70.92 0.61 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.51 0.671 . . . . 0.0 110.087 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.418 ' O ' ' HD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.22 164.66 11.57 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.68 -179.283 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.2 t -85.44 115.16 26.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 173.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.625 ' O ' HG23 ' A' ' 112' ' ' ILE . 39.4 ttp -72.49 99.08 2.41 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.028 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.8 p -110.48 -9.99 14.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.839 -175.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -80.41 134.22 35.98 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.851 0.834 . . . . 0.0 110.443 178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.723 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 6.2 mpt_? -72.99 -29.12 62.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.227 -1.352 . . . . 0.0 110.681 -170.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.677 ' HB3' ' HG ' ' A' ' 25' ' ' LEU . 3.3 mm? -76.13 -15.25 60.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.495 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.57 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -84.46 -58.73 2.62 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.8 -47.53 1.8 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.187 -0.915 . . . . 0.0 114.096 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.403 ' HB3' HD13 ' A' ' 23' ' ' LEU . 7.3 m -66.55 -43.93 83.72 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.292 1.046 . . . . 0.0 111.641 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.663 ' HB1' HD21 ' A' ' 25' ' ' LEU . . . -67.82 -23.97 65.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.87 0.367 . . . . 0.0 111.861 -177.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 48' ' ' ALA . 37.2 mm -65.6 -32.41 58.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.981 0.42 . . . . 0.0 110.835 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -132.12 53.7 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.499 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.567 ' SG ' HD11 ' A' ' 55' ' ' LEU . 25.8 p -115.16 -44.05 3.04 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.59 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.567 HD11 ' SG ' ' A' ' 54' ' ' CYS . 9.0 mp -54.52 -44.0 72.4 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.197 0.523 . . . . 0.0 111.534 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.8 -11.74 59.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.318 -173.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.792 ' HA ' ' CG1' ' A' ' 61' ' ' VAL . 13.2 m -83.63 -33.17 25.35 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.646 0.736 . . . . 0.0 110.211 174.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.535 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 13.3 mmmt -71.26 -31.48 67.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.249 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.95 -67.07 0.47 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.72 172.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -178.97 123.21 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.546 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.792 ' CG1' ' HA ' ' A' ' 57' ' ' THR . 7.9 p -177.42 32.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.431 0.634 . . . . 0.0 112.171 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.534 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.1 m -101.34 123.22 54.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.691 -1.256 . . . . 0.0 111.42 -177.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.437 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 12.3 t70 -73.5 -54.29 4.09 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.891 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.732 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 57.0 Cg_endo -104.62 -139.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 123.398 2.732 . . . . 0.0 113.066 -171.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.408 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 18.3 m-20 -73.25 3.0 6.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.673 -175.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.41 -75.47 0.33 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.785 -0.722 . . . . 0.0 111.35 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.667 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.2 p-10 -76.53 157.05 32.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.183 -0.508 . . . . 0.0 110.742 177.08 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.648 HD23 HD21 ' A' ' 67' ' ' ASN . 4.3 mm? 69.49 34.17 2.89 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.585 0.553 . . . . 0.0 111.22 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.732 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.7 p80 -73.71 79.98 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.439 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -87.69 -57.25 3.01 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.424 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.12 -63.08 5.03 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.086 -169.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -59.36 -22.86 61.96 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.431 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -72.7 -33.83 66.74 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.965 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 29.8 mmmt -78.82 -31.62 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.059 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -64.96 -39.97 94.29 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -61.64 -36.89 82.08 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.704 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.17 -40.85 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.828 0.346 . . . . 0.0 110.991 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.56 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 73.9 mtm -75.18 -19.76 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.199 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -90.13 -16.26 29.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.231 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.556 ' O ' HD12 ' A' ' 8' ' ' LEU . 52.9 m-70 -143.27 96.34 2.9 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.653 0.263 . . . . 0.0 110.37 -175.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.85 -62.64 0.3 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.125 172.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.71 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.43 139.74 38.93 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.046 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.508 ' OD2' HG21 ' A' ' 85' ' ' THR . 0.7 OUTLIER -82.25 169.02 17.03 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 168.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.511 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 12.2 pt-20 -68.09 -22.65 64.9 Favored 'General case' 0 N--CA 1.409 -2.487 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.298 -165.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.508 HG21 ' OD2' ' A' ' 83' ' ' ASP . 1.4 t -73.22 -29.43 62.79 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.08 -175.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 61.1 mtm -87.22 -38.82 16.01 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.601 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -60.21 -37.64 80.93 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.321 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.8 mp0 -77.2 -21.85 53.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.275 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 85' ' ' THR . 3.5 mm-40 -77.23 -22.12 52.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.027 171.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.485 ' O ' HG13 ' A' ' 94' ' ' ILE . 28.8 tp -88.26 -39.38 14.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.65 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.601 HG12 ' O ' ' A' ' 87' ' ' ALA . 18.2 m -57.59 -35.92 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -171.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.71 -38.13 83.18 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.036 -175.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.872 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.5 mp -65.79 -39.59 85.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 171.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.485 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.6 mt -58.04 -48.19 84.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.988 -178.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -70.93 -36.4 72.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.517 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.12 -46.09 6.02 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.17 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.525 ' SG ' HG23 ' A' ' 93' ' ' ILE . 48.7 m -72.73 -38.27 67.49 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 116.494 0.147 . . . . 0.0 110.919 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.55 -39.3 76.35 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.295 -0.253 . . . . 0.0 110.983 170.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -74.33 -43.01 58.48 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.144 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.1 m -94.57 14.55 20.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.708 -173.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.21 151.39 81.71 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.509 ' C ' ' H ' ' A' ' 104' ' ' ASN . 51.5 Cg_exo -56.63 163.26 7.23 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.924 2.416 . . . . 0.0 112.189 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.92 33.34 0.13 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.482 2.788 . . . . 0.0 113.168 177.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.509 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.4 m-20 -121.81 101.9 7.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -79.56 96.12 6.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.99 0.9 . . . . 0.0 109.546 178.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -90.42 104.73 17.27 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.619 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -31.29 -77.26 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 O-C-N 124.824 1.328 . . . . 0.0 113.735 -169.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 42.2 t -95.91 -11.08 27.21 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.826 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 1.9 tmm? -86.89 -16.34 36.3 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 112.613 -169.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.61 ' HG3' ' H ' ' A' ' 111' ' ' THR . 22.5 pttt -55.59 -45.94 77.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.769 0.795 . . . . 0.0 111.068 -173.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.61 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 12.6 t -57.33 -13.73 3.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.426 -1.261 . . . . 0.0 112.843 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.662 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -90.45 -37.35 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -58.09 -37.03 73.73 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.687 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.518 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -79.42 -36.48 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.38 0.609 . . . . 0.0 110.447 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.19 70.64 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.373 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.707 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 19.5 ptt? -69.59 -17.89 63.58 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.201 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.518 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 53.0 t -73.26 -22.36 60.41 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.872 ' HB2' HG22 ' A' ' 93' ' ' ILE . 54.2 t80 -81.0 -46.3 15.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.686 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.64 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.29 -17.52 63.09 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 118.309 -1.356 . . . . 0.0 109.397 175.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.707 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.47 -55.3 21.67 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.149 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 8.0 mm-40 -58.95 -51.3 70.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.642 175.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.33 -32.9 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 178.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -70.9 -32.8 69.86 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.038 -0.413 . . . . 0.0 112.057 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -73.76 -34.37 64.68 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.441 0.638 . . . . 0.0 109.959 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 79.1 mt -76.16 4.74 8.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.936 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -92.38 126.76 37.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.007 0.432 . . . . 0.0 110.537 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . 0.573 ' O ' ' HD3' ' A' ' 129' ' ' PRO . 11.4 p-90 -109.3 179.65 4.09 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.744 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.99 103.3 16.67 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 121.315 0.579 . . . . 0.0 110.925 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.573 ' HD3' ' O ' ' A' ' 127' ' ' TRP . 5.4 Cg_exo -80.21 127.21 6.63 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.874 2.382 . . . . 0.0 111.632 178.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -93.81 3.53 55.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.87 0.843 . . . . 0.0 109.276 178.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 23.5 ptp -128.87 158.21 39.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.66 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -146.24 97.22 2.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.885 0.85 . . . . 0.0 110.107 171.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.29 83.23 4.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.536 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 6.4 m -86.16 88.84 2.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.318 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -101.18 124.86 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.797 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 155.38 32.95 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -77.02 109.41 10.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.179 -0.51 . . . . 0.0 110.576 -176.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.0 t -87.02 124.04 40.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 176.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.4 tp -75.57 103.6 5.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.425 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -114.5 81.89 1.63 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.637 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.754 ' HG3' HG21 ' A' ' 142' ' ' VAL . 16.8 pt-20 -99.26 -35.61 9.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.438 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.754 HG21 ' HG3' ' A' ' 141' ' ' GLU . 19.7 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.591 -0.719 . . . . 0.0 109.285 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.52 0.2 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -65.91 -21.91 56.59 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.52 2.147 . . . . 0.0 112.351 -179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -49.29 -66.47 0.39 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.044 177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tp -75.36 -15.6 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 121.17 0.51 . . . . 0.0 111.517 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 73.7 mtp -76.84 -40.61 47.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -80.12 97.05 6.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.91 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -62.38 123.27 17.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.342 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.07 -36.41 77.29 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.286 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 m -60.29 -34.64 74.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -75.0 -32.76 61.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.019 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -67.92 -45.06 75.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.721 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -57.1 -86.5 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 169.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.81 37.91 44.41 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.492 -178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -61.45 -59.31 5.44 Favored 'General case' 0 C--N 1.335 -0.042 0 CA-C-O 121.227 0.536 . . . . 0.0 110.437 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.45 100.55 3.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.965 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.514 ' HG2' ' OH ' ' A' ' 34' ' ' TYR . 17.0 tpt -74.61 -22.3 59.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.759 -178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -53.89 -31.53 50.21 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.473 -175.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.515 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 26.3 mt-30 -87.42 -21.33 25.66 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.834 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 32.1 t -75.27 -36.17 61.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 170.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.545 ' HA ' HD22 ' A' ' 25' ' ' LEU . 29.7 tptp -58.27 -51.07 71.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.636 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.13 -47.79 48.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.91 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 5.8 mm-40 -69.7 -32.28 70.79 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.582 HD23 ' HB2' ' A' ' 54' ' ' CYS . 1.5 mm? -90.6 -21.46 21.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 61.91 50.28 4.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.117 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.545 HD22 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -63.12 125.7 87.48 Favored Pre-proline 0 CA--C 1.52 -0.188 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.959 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.488 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.7 Cg_exo -64.68 150.6 87.92 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.696 1.597 . . . . 0.0 109.4 168.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -54.99 -33.82 62.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.909 0.385 . . . . 0.0 111.676 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -78.58 -29.84 46.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.004 -174.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.1 t -77.22 -49.44 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 121.101 -0.24 . . . . 0.0 111.303 -179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.5 p -60.43 -27.36 39.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 121.114 0.483 . . . . 0.0 109.811 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.91 -52.02 33.77 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.699 173.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -63.65 -33.29 75.29 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.321 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.1 tp -51.02 -55.46 17.36 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.722 170.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.514 ' OH ' ' HG2' ' A' ' 16' ' ' MET . 18.4 m-85 -68.51 12.15 0.14 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 176.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.56 123.33 16.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 119.859 1.208 . . . . 0.0 110.419 -173.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -72.26 -36.24 68.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.719 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.2 m-90 -92.9 101.82 14.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.245 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -76.37 78.17 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.186 0.517 . . . . 0.0 109.896 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.536 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 34.5 t70 -62.51 12.1 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.0 t0 53.81 43.05 31.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.227 0.921 . . . . 0.0 110.047 -174.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.536 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 13.1 p90 -86.7 175.02 8.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.981 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -95.59 125.63 48.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.65 ' HE2' HD13 ' A' ' 52' ' ' ILE . 42.6 ttm -68.45 103.65 1.71 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.058 0.456 . . . . 0.0 110.251 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.9 p -93.31 -39.47 10.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.842 -174.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -83.57 134.56 34.81 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.924 0.868 . . . . 0.0 111.025 -176.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.509 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 4.2 mpt_? -74.98 -30.14 61.09 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.11 -1.404 . . . . 0.0 110.149 -173.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.504 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -66.55 -15.23 63.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.796 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.492 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.74 -56.76 3.93 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.552 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -40.33 -47.29 3.61 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-N 114.933 -1.03 . . . . 0.0 114.58 165.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 20.8 m -66.28 -44.52 83.33 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 118.786 1.293 . . . . 0.0 110.28 -178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.18 -17.3 63.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.553 -175.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.65 HD13 ' HE2' ' A' ' 43' ' ' MET . 71.4 mt -54.37 -37.76 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.083 0.468 . . . . 0.0 110.22 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -143.79 71.96 1.34 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.317 0.58 . . . . 0.0 109.725 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.582 ' HB2' HD23 ' A' ' 23' ' ' LEU . 23.1 p -104.52 -45.93 4.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.385 176.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.4 tp -62.37 -47.28 84.86 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.417 -176.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.84 -16.25 51.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.904 0.383 . . . . 0.0 110.772 -173.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.524 HG21 ' CG1' ' A' ' 61' ' ' VAL . 55.3 m -84.06 -36.93 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.587 174.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.483 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 15.6 mmmt -68.31 -25.0 64.9 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.246 -0.284 . . . . 0.0 111.273 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.3 mt -64.49 -66.09 0.59 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 121.098 -0.241 . . . . 0.0 110.934 176.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -176.76 121.83 0.14 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.515 0.198 . . . . 0.0 110.744 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.524 ' CG1' HG21 ' A' ' 57' ' ' THR . 13.9 p -173.29 50.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.256 1.027 . . . . 0.0 110.267 -176.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.571 ' HA ' ' HB2' ' A' ' 69' ' ' HIS . 1.5 m -110.1 125.8 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 121.601 -0.687 . . . . 0.0 111.249 -173.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -76.78 -56.14 1.4 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.265 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.688 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 16.4 Cg_endo -98.34 -139.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.504 2.803 . . . . 0.0 112.851 -171.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.474 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 28.8 t70 -71.5 -1.5 13.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.512 -177.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.44 -65.57 0.5 Allowed Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.34 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.688 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p-10 -76.31 149.57 37.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.549 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 68.6 40.67 1.83 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.318 0.58 . . . . 0.0 111.176 174.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.571 ' HB2' ' HA ' ' A' ' 62' ' ' VAL . 8.3 p80 -74.73 69.54 1.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.511 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -82.22 -50.71 8.69 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.91 -56.16 26.34 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.837 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.68 -27.75 66.68 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.38 -36.71 66.12 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.454 0.645 . . . . 0.0 110.722 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -78.65 -37.85 41.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.68 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 18.9 t70 -66.72 -32.49 73.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.464 173.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -57.69 -42.04 82.88 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.995 0.426 . . . . 0.0 110.126 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 -34.86 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.679 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 72.7 mtm -74.42 -26.49 60.11 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 4.8 ptpp? -93.03 -18.47 22.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.714 -0.795 . . . . 0.0 110.933 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -134.53 91.44 2.78 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 124.31 -74.52 0.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.705 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -91.74 132.61 36.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.867 0.365 . . . . 0.0 111.315 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.465 ' OD1' HG21 ' A' ' 85' ' ' THR . 0.9 OUTLIER -85.11 173.57 10.36 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 15.8 mt-10 -59.59 -34.45 72.75 Favored 'General case' 0 N--CA 1.418 -2.058 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -170.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.787 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 5.2 t -63.61 -31.42 72.59 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.362 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 46.1 mtt -82.5 -39.66 22.14 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -64.23 -37.32 87.07 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.556 177.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -75.69 -26.17 57.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.502 -175.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 85' ' ' THR . 54.2 mm-40 -80.14 -24.26 40.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.67 172.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.468 ' O ' HG13 ' A' ' 94' ' ' ILE . 42.0 tp -84.15 -46.38 11.97 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.085 -176.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 15.2 m -56.88 -36.76 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.869 -176.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.58 -43.53 80.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.437 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.663 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.6 mp -69.11 -43.32 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.245 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.7 mt -55.65 -47.79 78.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.669 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -71.06 -35.16 71.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.698 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.15 -45.25 6.32 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.491 -173.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.663 ' SG ' HG23 ' A' ' 93' ' ' ILE . 60.1 m -72.65 -37.05 68.09 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.117 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.09 -39.32 93.81 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.282 0.492 . . . . 0.0 110.719 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.92 -34.15 77.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.08 0.467 . . . . 0.0 110.48 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 m -104.09 17.19 24.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.973 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.76 155.97 67.95 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.252 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.06 143.84 91.68 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.968 1.779 . . . . 0.0 110.473 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.55 72.28 0.43 Allowed 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.665 2.243 . . . . 0.0 112.908 -176.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -125.62 95.21 4.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.823 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -76.51 96.31 4.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.191 0.519 . . . . 0.0 111.321 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 1.071 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.2 t70 -143.92 120.34 10.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.756 174.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.739 ' HZ1' ' HB2' ' A' ' 107' ' ' LYS . 3.9 ttmp? -34.68 -60.84 0.42 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 178.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.485 ' O ' HD11 ' A' ' 112' ' ' ILE . 5.9 m -89.51 -10.13 47.42 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 1.071 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 1.3 tmm? -69.03 -42.97 75.65 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-O 122.214 1.007 . . . . 0.0 110.092 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.648 ' HG3' ' H ' ' A' ' 111' ' ' THR . 14.4 ptpt -64.92 -49.98 68.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.169 -1.378 . . . . 0.0 111.342 -172.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.648 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 11.6 t -57.98 -14.98 7.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.68 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.552 HD13 ' HA3' ' A' ' 49' ' ' GLY . 1.5 mp -91.66 -40.71 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.641 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 8.5 t70 -61.94 -34.91 76.96 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.078 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.645 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.1 m -81.53 -37.38 15.36 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.865 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -60.2 -51.78 68.1 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-O 120.817 0.341 . . . . 0.0 111.795 -179.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.641 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -69.43 -26.02 64.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.015 179.635 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 32.3 t -68.52 -24.76 64.69 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.112 0.482 . . . . 0.0 109.837 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.576 ' HA ' HG12 ' A' ' 93' ' ' ILE . 37.8 t80 -77.31 -49.73 14.37 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.845 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -23.65 61.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.824 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.63 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.92 -54.43 46.27 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 118.869 0.758 . . . . 0.0 109.367 167.469 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.425 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 6.8 tp10 -58.07 -50.4 73.6 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.87 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.85 -32.89 22.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 117.742 0.246 . . . . 0.0 111.161 177.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 2.7 m-70 -71.29 -32.88 69.17 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.416 ' C ' ' H ' ' A' ' 126' ' ' ASN . 19.3 tptm -78.47 -31.26 47.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 0.0 109.862 174.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 91.4 mt -72.47 11.36 0.63 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.52 175.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 0.416 ' H ' ' C ' ' A' ' 124' ' ' LYS . 19.4 t-20 -55.87 152.61 9.68 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -73.69 78.02 1.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 122.155 0.978 . . . . 0.0 110.403 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 30.6 m -120.5 137.63 26.45 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.495 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -77.03 114.19 3.76 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 123.06 2.507 . . . . 0.0 111.999 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.603 ' HB3' ' OD1' ' A' ' 132' ' ' ASP . 55.8 t30 -95.23 176.76 6.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 22.2 ptp -79.51 7.86 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.651 0.262 . . . . 0.0 111.21 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.603 ' OD1' ' HB3' ' A' ' 130' ' ' ASN . 4.4 p-10 -94.15 127.98 40.29 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 50.0 tp -116.93 122.58 44.7 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.152 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 13.4 m -119.28 111.17 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.154 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 38.9 mm -109.7 100.61 11.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.243 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -80.94 94.52 1.57 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.184 176.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.11 148.04 38.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.884 0.373 . . . . 0.0 110.686 -177.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.2 t -123.14 125.33 71.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.689 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.4 tp -126.58 112.08 15.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.877 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.23 -166.57 1.43 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.239 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.64 148.94 32.28 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.026 0.441 . . . . 0.0 110.35 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.858 178.541 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.487 0.184 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -59.04 -22.1 62.15 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.959 2.439 . . . . 0.0 112.552 178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -50.03 -67.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 111.341 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.763 HD13 ' HB2' ' A' ' 82' ' ' ALA . 23.4 mm -76.17 -16.25 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 121.066 0.46 . . . . 0.0 111.326 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 5.2 tmm? -68.4 -43.62 76.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.521 ' HE3' ' OD1' ' A' ' 11' ' ' ASN . 41.9 tptt -80.73 85.54 6.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.356 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.459 ' OD1' ' HB2' ' A' ' 10' ' ' ASN . 3.0 p30 -62.65 125.55 24.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.218 -175.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.662 ' H ' HD22 ' A' ' 8' ' ' LEU . 1.9 pt? -61.85 -30.2 70.69 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.506 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -61.6 -41.49 97.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.796 0.331 . . . . 0.0 110.855 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.459 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m120 -78.05 -18.9 55.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.13 176.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.592 ' ND2' ' HA ' ' A' ' 8' ' ' LEU . 96.9 m-20 -66.51 -52.18 48.73 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -57.21 -84.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.941 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.54 34.79 35.7 Favored Glycine 0 C--N 1.344 0.989 0 C-N-CA 121.356 -0.45 . . . . 0.0 114.111 178.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.97 -56.27 23.75 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 117.272 0.536 . . . . 0.0 111.163 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.634 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -144.64 107.31 4.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.886 0.374 . . . . 0.0 110.879 -177.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.7 mtm -70.18 -32.5 70.47 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.747 0.308 . . . . 0.0 110.818 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.7 -22.8 67.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.915 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.634 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 3.2 pt20 -83.94 -27.02 28.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.077 -176.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.405 ' O ' HD21 ' A' ' 23' ' ' LEU . 8.8 t -75.47 -35.64 60.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 173.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.742 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.32 -48.28 80.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.043 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.75 -44.13 43.21 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.276 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -63.3 -41.82 99.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.452 0.168 . . . . 0.0 111.262 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.624 HD23 ' HB2' ' A' ' 54' ' ' CYS . 3.4 mm? -79.21 -22.82 44.34 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.8 m 60.83 50.02 5.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.301 -175.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.742 HD22 ' HA ' ' A' ' 20' ' ' LYS . 1.6 mm? -61.29 131.08 92.14 Favored Pre-proline 0 N--CA 1.461 0.122 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.521 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 5.8 Cg_exo -73.69 154.24 49.17 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.144 1.896 . . . . 0.0 110.441 168.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.579 ' HA ' HG23 ' A' ' 30' ' ' VAL . 0.9 OUTLIER -65.98 -26.98 67.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.018 0.437 . . . . 0.0 110.801 -176.077 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -63.37 -40.67 97.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.279 0.561 . . . . 0.0 110.073 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' A' ' 47' ' ' LEU . 24.4 t -77.22 -43.8 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.342 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.579 HG23 ' HA ' ' A' ' 27' ' ' ASP . 27.7 m -56.02 -37.24 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 121.157 0.503 . . . . 0.0 109.997 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.19 -51.91 58.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.672 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.63 -37.1 86.41 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.163 0.506 . . . . 0.0 110.524 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -43.48 95.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.02 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.0 9.68 2.81 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -65.93 131.56 46.55 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.048 0.84 . . . . 0.0 110.666 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -91.1 -7.72 50.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.994 0.425 . . . . 0.0 110.903 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 6.9 m-90 -91.15 102.38 15.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.687 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -90.52 65.46 6.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -62.77 12.58 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.2 t0 54.54 71.52 0.52 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.559 1.072 . . . . 0.0 109.75 -169.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -115.34 157.12 24.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.245 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 67.1 t -86.2 116.15 28.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.535 ' SD ' ' HB3' ' A' ' 48' ' ' ALA . 55.3 tpp -71.26 103.71 2.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.566 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -99.94 -9.13 23.13 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -90.39 127.78 36.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 109.718 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.614 ' N ' ' HD3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -78.48 -19.59 52.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.288 -170.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.692 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -75.76 -19.37 59.07 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.228 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.535 ' HB3' ' SD ' ' A' ' 43' ' ' MET . . . -85.29 -59.07 2.43 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.42 -47.68 2.86 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-N 115.176 -0.92 . . . . 0.0 114.083 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 m -65.4 -45.49 83.78 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 118.207 1.003 . . . . 0.0 111.619 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.14 -3.06 24.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.0 mm -59.73 -35.78 61.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -145.2 82.65 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 173.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.624 ' HB2' HD23 ' A' ' 23' ' ' LEU . 21.4 p -108.79 -45.53 3.8 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.889 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.464 HD12 ' H ' ' A' ' 15' ' ' ALA . 6.7 tt -63.99 -44.43 92.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.932 -174.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.63 55.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.037 0.446 . . . . 0.0 110.371 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.513 HG21 ' CG1' ' A' ' 61' ' ' VAL . 43.6 m -80.9 -32.0 34.96 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.581 175.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 19.2 mmmt -82.04 -16.75 49.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.846 177.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.2 mt -66.71 -67.17 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 171.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -178.1 127.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.513 ' CG1' HG21 ' A' ' 57' ' ' THR . 9.3 p -172.56 32.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 122.109 0.957 . . . . 0.0 109.778 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.586 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.0 m -102.79 120.95 53.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 O-C-N 121.769 -0.582 . . . . 0.0 111.605 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.3 -56.78 5.06 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.427 174.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.661 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 17.8 Cg_endo -100.74 -140.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.355 2.703 . . . . 0.0 113.271 -170.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -75.3 5.49 5.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.58 -175.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 139.75 -75.46 0.36 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -177.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.715 HD21 HD23 ' A' ' 68' ' ' LEU . 2.0 p-10 -69.07 156.77 38.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.827 -0.686 . . . . 0.0 110.901 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.715 HD23 HD21 ' A' ' 67' ' ' ASN . 4.0 mm? 70.05 29.21 3.91 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.266 0.626 . . . . 0.0 112.533 174.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.6 p-80 -78.08 67.57 3.95 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.254 0.549 . . . . 0.0 111.284 174.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.44 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 9.0 p80 -86.61 -45.74 10.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.837 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.96 -55.36 30.77 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.317 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -59.94 -28.39 67.58 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.705 -0.248 . . . . 0.0 111.488 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.62 -34.98 74.83 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.345 0.593 . . . . 0.0 110.983 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 70.5 mmtt -78.56 -37.32 43.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 109.241 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.77 -40.01 94.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.637 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -62.59 -34.06 76.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.073 177.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.08 -32.08 69.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.994 177.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 89.1 mtp -70.67 -35.14 72.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.778 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -90.28 -14.83 32.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.478 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -140.05 92.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.361 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.29 -73.59 0.46 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.876 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.763 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -104.39 145.26 30.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.959 0.409 . . . . 0.0 111.248 -175.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.636 ' OD2' HG21 ' A' ' 85' ' ' THR . 1.0 OUTLIER -87.78 177.13 7.09 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.027 175.205 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -40.45 65.56 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.38 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.724 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 13.0 t -72.12 -33.55 67.9 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.119 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.49 ' HB2' ' HB3' ' A' ' 82' ' ' ALA . 68.6 mtp -81.4 -39.15 25.43 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 121.96 -0.463 . . . . 0.0 109.886 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -60.22 -37.92 81.78 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 173.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.36 -24.93 60.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.685 -177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.724 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.2 mm-40 -79.87 -25.92 40.5 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.404 -0.518 . . . . 0.0 109.898 173.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.516 ' O ' HG13 ' A' ' 94' ' ' ILE . 22.7 tp -87.62 -44.2 11.4 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.954 -174.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.438 HG12 ' O ' ' A' ' 87' ' ' ALA . 14.5 m -57.24 -36.03 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.179 -176.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.41 -44.18 95.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.952 0.406 . . . . 0.0 110.181 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.522 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -68.32 -42.38 84.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.234 175.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 90' ' ' LEU . 57.8 mt -54.87 -49.2 72.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.307 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -70.77 -35.12 72.45 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.487 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.4 -56.39 2.84 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.26 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 21.7 m -72.73 -29.73 63.59 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.17 -34.17 76.97 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.631 0.651 . . . . 0.0 110.108 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -70.39 -42.96 71.02 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.832 0.349 . . . . 0.0 111.137 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -94.08 10.37 33.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.763 0.316 . . . . 0.0 111.688 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.435 ' HB3' ' HD2' ' A' ' 102' ' ' PRO . . . -64.53 156.3 77.93 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.47 ' C ' ' H ' ' A' ' 104' ' ' ASN . 9.8 Cg_endo -50.87 156.4 4.74 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.251 2.634 . . . . 0.0 112.464 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.7 Cg_exo -68.68 24.48 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.555 2.837 . . . . 0.0 113.496 -175.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 102' ' ' PRO . 17.0 m120 -110.79 105.12 13.86 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.54 84.95 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.159 0.504 . . . . 0.0 109.944 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.728 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.8 t70 -101.17 103.94 15.0 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.563 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -37.58 -50.39 1.14 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 114.317 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.527 ' O ' HG22 ' A' ' 111' ' ' THR . 5.4 t -95.26 -20.93 18.78 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.037 0.835 . . . . 0.0 113.189 -176.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.728 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 56.2 mmm -74.55 -29.07 61.22 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.026 0.83 . . . . 0.0 112.334 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.482 ' HG3' ' H ' ' A' ' 111' ' ' THR . 27.5 pttt -56.34 -45.45 80.39 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.492 -172.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 108' ' ' CYS . 14.6 t -57.61 -16.36 10.13 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.711 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.527 ' O ' ' HG3' ' A' ' 116' ' ' MET . 3.1 mp -90.07 -37.2 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.8 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 6.4 m-20 -59.43 -37.98 79.5 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.865 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.95 -37.45 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.55 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.01 -52.67 64.01 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.8 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -69.72 -19.73 63.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.396 178.681 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.567 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 5.0 t -71.58 -30.62 66.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.493 173.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.4 ' HA ' HG12 ' A' ' 93' ' ' ILE . 86.7 t80 -76.78 -45.95 26.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.794 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.405 ' HA ' HG23 ' A' ' 122' ' ' ILE . 3.3 pttp -70.32 -30.0 66.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.357 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.567 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -66.69 -44.44 81.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.179 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 23.9 mm-40 -59.01 -53.54 57.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.172 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.505 ' HA ' HD11 ' A' ' 125' ' ' LEU . 8.5 tt -55.74 -32.93 32.74 Favored 'Isoleucine or valine' 0 C--N 1.345 0.4 0 CA-C-N 118.023 0.374 . . . . 0.0 111.401 -178.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.495 ' N ' HG22 ' A' ' 122' ' ' ILE . 7.2 m170 -71.3 -33.37 69.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.2 ttpt -76.59 -15.58 59.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.238 0.542 . . . . 0.0 110.7 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 87.0 mt -81.18 10.49 5.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.601 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -135.0 -126.62 0.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 O-C-N 122.236 -0.29 . . . . 0.0 110.281 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -67.11 99.71 0.7 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.967 0.413 . . . . 0.0 111.598 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.413 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 12.9 p -164.35 132.67 2.67 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.203 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 3.9 Cg_exo -78.15 54.99 5.16 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.091 2.527 . . . . 0.0 111.599 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -79.42 106.41 11.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.019 0.438 . . . . 0.0 110.644 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.7 ptt? -147.55 123.0 10.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.932 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -117.72 162.76 17.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.22 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.4 tp -77.47 99.45 5.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.89 0.376 . . . . 0.0 110.043 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 11.0 m -66.23 111.67 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.859 178.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -88.12 133.73 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-O 121.083 0.468 . . . . 0.0 110.251 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -132.5 136.18 8.58 Favored Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.39 110.85 12.49 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.666 0.27 . . . . 0.0 110.857 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 32.3 t -89.09 76.96 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.45 ' CD1' ' H ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -78.3 138.61 38.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.759 -174.556 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.42 101.07 6.97 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.576 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -77.09 146.44 37.24 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.1 m . . . . . 0 C--O 1.248 1.015 0 CA-C-O 119.071 -0.49 . . . . 0.0 111.399 -177.869 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.717 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 8.0 m . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 111.463 0.172 . . . . 0.0 111.463 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.717 ' HD3' ' HB2' ' A' ' 1' ' ' SER . 36.2 Cg_exo -62.83 -18.05 62.61 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.517 2.145 . . . . 0.0 113.578 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -45.02 -69.52 0.13 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.544 0.527 . . . . 0.0 112.133 -176.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.537 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -87.2 -9.09 11.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 75.4 mtp -74.93 -25.6 59.01 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -177.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' A' ' 2' ' ' PRO . 21.3 pttp -97.03 89.26 4.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.449 0.642 . . . . 0.0 109.721 173.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.02 125.18 24.09 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.003 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -59.32 -33.85 71.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.781 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -61.86 -38.07 86.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.164 0.507 . . . . 0.0 110.082 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -75.39 -30.91 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.302 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.24 -55.99 10.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.296 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -47.78 -74.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.034 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.589 ' HA2' ' HG3' ' A' ' 16' ' ' MET . . . 54.65 33.48 55.03 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.219 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -68.38 -43.05 78.21 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.506 0.653 . . . . 0.0 110.189 178.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.12 66.78 1.31 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.172 0.51 . . . . 0.0 110.905 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.589 ' HG3' ' HA2' ' A' ' 13' ' ' GLY . 73.4 mtm -70.35 -25.01 63.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.78 -31.86 62.98 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.663 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -87.97 -25.37 23.2 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.059 -0.656 . . . . 0.0 111.091 -172.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -71.46 -35.33 70.84 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.923 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.31 -52.62 62.93 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.114 -178.063 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.03 -36.95 67.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.53 -175.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -68.63 -42.27 78.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.727 0.299 . . . . 0.0 111.201 -175.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.731 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 18.0 mt -84.2 -1.08 54.52 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.822 0.344 . . . . 0.0 110.664 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 63.69 36.59 10.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.304 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.923 ' HB2' ' HD3' ' A' ' 20' ' ' LYS . 1.2 mm? -49.41 119.16 8.87 Favored Pre-proline 0 N--CA 1.471 0.59 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.73 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.525 ' HD2' ' CD2' ' A' ' 47' ' ' LEU . 12.7 Cg_exo -73.93 154.17 47.87 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.416 2.077 . . . . 0.0 109.861 167.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -55.79 -32.9 63.91 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -66.03 -53.02 43.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.855 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.568 ' CB ' HD21 ' A' ' 47' ' ' LEU . 36.0 t -70.35 -50.68 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.718 -176.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.498 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 8.8 p -59.7 -33.4 51.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.152 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.93 -51.17 58.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.556 177.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.92 -32.58 73.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.064 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.6 tp -48.44 -55.38 11.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.081 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.92 13.39 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.466 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 52.0 t30 -53.86 122.31 9.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 119.521 1.055 . . . . 0.0 111.803 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -71.79 -33.15 68.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.917 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 31.0 m-90 -79.04 145.41 33.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.14 0.495 . . . . 0.0 110.965 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.558 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.65 54.28 2.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.462 -173.516 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.509 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 27.7 t70 -43.52 -42.59 5.03 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.9 t70 63.08 70.44 0.54 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 118.861 0.755 . . . . 0.0 109.853 -175.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.509 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 1.5 p90 -106.3 175.5 5.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.8 -175.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.422 HG12 HG21 ' A' ' 44' ' ' THR . 93.6 t -84.1 125.14 40.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.754 174.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttp -77.71 96.03 4.77 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.214 0.531 . . . . 0.0 110.226 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.422 HG21 HG12 ' A' ' 42' ' ' VAL . 9.4 p -103.42 -39.11 6.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.755 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -69.42 124.85 24.96 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.74 0.781 . . . . 0.0 110.07 -179.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.549 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 2.5 mpt_? -79.89 -28.06 39.92 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.717 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.582 HD23 HD11 ' A' ' 25' ' ' LEU . 7.4 tp -69.61 -19.06 63.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.948 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.562 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -78.37 -60.61 2.3 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.91 -46.78 1.78 Allowed Glycine 0 CA--C 1.534 1.227 0 CA-C-N 114.399 -1.273 . . . . 0.0 114.654 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 74.2 m -66.85 -43.61 83.2 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.522 1.161 . . . . 0.0 110.619 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.5 -22.07 66.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.761 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.562 HG12 ' O ' ' A' ' 48' ' ' ALA . 47.8 mm -61.83 -36.23 72.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-O 120.903 0.382 . . . . 0.0 111.127 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -122.2 76.88 1.34 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.557 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.7 p -125.19 -47.29 1.76 Allowed 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.301 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.9 tt -63.53 -65.51 0.67 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 111.786 -168.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.15 -12.47 59.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.252 0.548 . . . . 0.0 110.016 -174.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.511 ' HA ' HG12 ' A' ' 61' ' ' VAL . 56.3 m -83.9 -33.05 24.83 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.726 176.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.503 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 8.1 mmmt -75.35 -23.44 57.2 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.363 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.5 mt -63.79 -66.28 0.56 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.571 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -177.4 123.96 0.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.511 HG12 ' HA ' ' A' ' 57' ' ' THR . 10.4 p -178.67 34.57 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.99 0.9 . . . . 0.0 110.139 -174.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.693 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 28.1 m -98.82 114.02 35.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.802 0.811 . . . . 0.0 112.227 -170.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.23 -56.31 10.99 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.954 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.566 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 13.6 Cg_endo -97.91 -138.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 123.311 2.674 . . . . 0.0 113.254 -170.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.2 m-20 -72.24 2.39 6.06 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.622 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.19 -75.92 0.3 Allowed Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.566 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.8 p-10 -75.17 170.91 15.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.803 -0.699 . . . . 0.0 110.317 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 69.66 29.79 4.11 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.519 0.512 . . . . 0.0 111.621 173.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.693 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 3.5 p80 -73.11 79.89 1.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.392 0.615 . . . . 0.0 110.984 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -85.1 -58.85 2.52 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.651 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.0 -61.49 6.37 Favored Glycine 0 N--CA 1.443 -0.867 0 C-N-CA 121.154 -0.545 . . . . 0.0 113.171 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -54.1 -36.02 62.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.434 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -71.55 -37.89 71.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.204 0.525 . . . . 0.0 111.337 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HZ2' HG23 ' A' ' 94' ' ' ILE . 92.2 mttt -81.37 -30.45 33.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.002 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.13 -41.64 94.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.144 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.857 ' HD1' ' HE2' ' A' ' 80' ' ' HIS . 2.5 m-85 -62.57 -36.65 83.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.857 176.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.9 -40.27 75.73 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.639 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.621 ' HB3' ' CB ' ' A' ' 87' ' ' ALA . 1.7 ptt? -76.92 -14.87 59.82 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.635 ' HG3' ' HD2' ' A' ' 80' ' ' HIS . 18.5 ptpt -90.88 -18.61 24.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.126 173.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.857 ' HE2' ' HD1' ' A' ' 76' ' ' PHE . 12.3 p80 -149.77 99.49 2.86 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.683 0.278 . . . . 0.0 111.565 172.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.18 -75.97 0.41 Allowed Glycine 0 C--O 1.234 0.123 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.099 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.598 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.22 149.94 22.88 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.642 ' OD2' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -88.7 167.4 13.36 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.583 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -72.56 -23.31 60.96 Favored 'General case' 0 N--CA 1.421 -1.907 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.716 -166.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.642 ' HB ' ' OD2' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -73.29 -34.35 65.71 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.338 176.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.41 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 3.3 tpt -77.27 -43.52 33.02 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.111 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.621 ' CB ' ' HB3' ' A' ' 78' ' ' MET . . . -65.24 -41.59 94.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.353 175.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.583 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -69.23 -26.25 64.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -175.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 86' ' ' MET . 28.7 pt20 -82.78 -28.9 29.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.844 175.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -76.93 -46.73 23.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.433 ' HA ' HD12 ' A' ' 94' ' ' ILE . 25.4 m -57.69 -35.9 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.892 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.21 -44.51 88.06 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.924 0.392 . . . . 0.0 110.567 -176.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.514 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.2 mp -60.21 -42.66 91.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.455 174.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.607 HG23 ' HZ2' ' A' ' 74' ' ' LYS . 59.6 mt -55.25 -47.17 78.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.312 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -67.07 -31.45 71.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.429 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.404 ' O ' ' HB3' ' A' ' 99' ' ' LYS . . . -80.97 -50.67 5.08 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.374 -173.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 13.8 m -73.61 -32.75 64.24 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.171 -0.612 . . . . 0.0 112.21 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.533 ' CD ' ' HZ1' ' A' ' 110' ' ' LYS . 8.7 tp10 -57.89 -38.48 75.87 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.434 0.561 . . . . 0.0 110.416 168.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 96' ' ' GLY . 31.8 ttpt -63.48 -40.85 98.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.592 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.8 m -102.11 24.41 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.305 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.69 152.92 49.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -69.87 162.19 43.08 Favored 'Trans proline' 0 CA--C 1.529 0.249 0 C-N-CA 122.578 2.186 . . . . 0.0 112.275 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -69.2 59.01 1.33 Allowed 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.402 2.735 . . . . 0.0 112.587 178.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -103.93 113.28 26.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.504 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -79.0 16.31 0.94 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.805 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.1 t70 -90.85 112.18 23.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.093 0.473 . . . . 0.0 110.581 -176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.628 ' HE3' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.47 -54.25 3.17 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.636 ' O ' HD11 ' A' ' 112' ' ' ILE . 68.4 m -83.33 -21.91 33.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.371 0.987 . . . . 0.0 112.187 -176.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.805 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 5.7 mmm -63.33 -44.54 94.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.161 0.505 . . . . 0.0 110.57 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.64 ' HA ' ' OD2' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -66.17 -49.26 67.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.058 -177.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.499 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.64 -13.83 4.53 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.98 175.183 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.636 HD11 ' O ' ' A' ' 108' ' ' CYS . 1.2 mp -91.06 -41.56 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 O-C-N 121.933 -0.479 . . . . 0.0 110.03 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.64 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 3.2 p30 -63.08 -34.15 76.97 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.494 177.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.574 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 18.8 m -80.09 -36.31 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.49 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -61.53 -50.5 72.42 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 121.701 0.763 . . . . 0.0 111.339 176.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.74 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.3 ptt? -68.72 -17.75 64.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.784 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.574 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 25.8 t -71.92 -30.55 65.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.601 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.514 ' HA ' HG12 ' A' ' 93' ' ' ILE . 85.4 t80 -72.04 -44.91 62.6 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.776 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.68 -29.25 66.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 118.139 -1.424 . . . . 0.0 111.276 179.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.74 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.61 -56.21 19.15 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.756 170.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.53 -51.04 71.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.409 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.453 HD11 HG21 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -57.23 -32.79 41.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 118.22 0.464 . . . . 0.0 111.287 179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -71.98 -31.9 66.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.455 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -79.05 -36.19 41.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.75 ' HA ' ' HB ' ' A' ' 128' ' ' VAL . 0.5 OUTLIER -72.15 -15.31 61.97 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.116 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -56.88 -54.63 44.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.748 0.309 . . . . 0.0 111.398 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 26.0 p-90 -112.22 27.12 9.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.75 ' HB ' ' HA ' ' A' ' 125' ' ' LEU . 7.0 p -40.01 109.12 0.56 Allowed Pre-proline 0 N--CA 1.468 0.472 0 O-C-N 124.125 0.891 . . . . 0.0 113.007 -171.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -94.12 -19.63 0.41 Allowed 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.293 2.662 . . . . 0.0 113.318 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -90.33 94.61 9.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.119 0.485 . . . . 0.0 110.51 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.09 21.45 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -111.4 119.89 40.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.652 -173.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 53.5 tp -160.09 111.4 1.95 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.325 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.5 p -86.99 102.44 12.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 110.654 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.42 118.95 45.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.935 178.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 174.35 143.27 4.33 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.963 -1.113 . . . . 0.0 112.41 176.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.592 ' HG2' ' H ' ' A' ' 138' ' ' VAL . 25.3 tt0 -128.24 176.88 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.592 ' H ' ' HG2' ' A' ' 137' ' ' GLU . 34.4 m -85.05 116.5 28.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.19 0.519 . . . . 0.0 111.458 -176.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 7.2 mp -74.23 92.86 2.27 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -88.45 169.69 11.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.769 -169.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.85 152.79 20.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.684 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.874 0 CA-C-O 119.584 -0.246 . . . . 0.0 110.396 -179.919 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.459 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 65.4 p . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.568 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 2.6 Cg_exo -77.27 5.73 4.86 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.546 2.83 . . . . 0.0 114.921 -170.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -49.06 -70.57 0.09 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.43 HD11 ' HB2' ' A' ' 82' ' ' ALA . 7.9 tp -86.31 -9.47 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 121.124 0.488 . . . . 0.0 111.467 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.568 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 85.3 mtp -77.71 -30.6 51.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.959 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.596 ' HE2' HD22 ' A' ' 11' ' ' ASN . 82.2 tttt -84.7 94.37 8.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.219 0.533 . . . . 0.0 109.838 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -71.94 115.6 11.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.182 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.579 ' H ' HD12 ' A' ' 8' ' ' LEU . 5.8 mp -58.48 -37.73 76.14 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.342 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.546 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 6.1 p -65.08 -28.74 69.67 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.96 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.98 -26.51 56.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.894 175.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.596 HD22 ' HE2' ' A' ' 6' ' ' LYS . 5.1 m-20 -66.82 -45.66 77.59 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.546 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 67.9 m-85 -55.23 -84.37 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.381 171.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.02 36.79 15.33 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.688 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -66.34 -37.62 85.75 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.812 0.339 . . . . 0.0 111.012 -177.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.14 92.23 2.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.071 0.462 . . . . 0.0 109.85 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttp -71.32 -33.08 69.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.0 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.0 -29.3 65.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.064 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -88.52 -21.23 24.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.876 -172.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.9 t -74.85 -36.17 62.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.67 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -63.49 -45.56 90.17 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.384 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.84 -47.63 58.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.87 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.9 tp10 -67.96 -40.69 83.15 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.406 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 2.2 mm? -77.81 -21.52 51.43 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 61.67 48.16 5.83 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.843 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.67 HD22 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -61.29 128.34 89.52 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.359 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.606 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.4 Cg_exo -66.46 149.85 84.42 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.812 1.675 . . . . 0.0 109.694 170.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -61.06 -31.65 71.3 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 121.152 -0.219 . . . . 0.0 110.975 -175.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.4 m -66.46 -46.39 76.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.875 0.369 . . . . 0.0 110.801 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.3 t -71.38 -52.73 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.626 -176.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.598 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 5.0 p -60.2 -34.97 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.871 -175.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.36 -51.52 59.88 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.94 0.4 . . . . 0.0 111.267 177.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.68 -37.46 76.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.578 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.52 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 1.6 pp -59.81 -30.64 69.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.536 177.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -62.86 9.8 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 174.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -56.03 110.18 0.7 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 120.474 1.488 . . . . 0.0 111.367 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -76.48 -14.96 60.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.059 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -88.2 157.95 18.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -87.07 53.6 2.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.779 0.8 . . . . 0.0 109.959 175.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.577 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 10.6 t70 -42.78 -45.5 4.84 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.818 177.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 63.04 70.47 0.55 Allowed 'General case' 0 C--N 1.347 0.481 0 CA-C-O 121.639 0.733 . . . . 0.0 109.85 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.577 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 14.9 p90 -109.76 164.05 12.93 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.305 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 38.2 t -84.17 113.91 23.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.516 ' HB3' HG23 ' A' ' 112' ' ' ILE . 38.6 ttm -70.99 104.32 2.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.17 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -108.22 -18.43 13.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.392 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.15 139.68 30.39 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.94 0.876 . . . . 0.0 111.382 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HA ' ' HG2' ' A' ' 109' ' ' MET . 6.7 mpt_? -70.72 -32.65 69.91 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.898 -1.501 . . . . 0.0 110.608 -171.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.607 ' HB3' HD12 ' A' ' 25' ' ' LEU . 4.3 mm? -73.62 -15.07 61.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.968 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.403 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.64 -61.03 2.09 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.74 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -40.11 -48.01 3.48 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.079 -0.964 . . . . 0.0 114.586 168.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 m -66.15 -42.66 88.72 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.495 1.148 . . . . 0.0 111.56 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.94 -23.14 67.25 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.2 mm -55.79 -38.35 51.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.053 0.454 . . . . 0.0 110.329 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.405 ' HB2' ' HG1' ' A' ' 57' ' ' THR . 5.1 p30 -131.27 81.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.214 1.007 . . . . 0.0 110.142 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.404 ' SG ' HD23 ' A' ' 23' ' ' LEU . 1.5 t -114.58 -47.19 2.92 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.706 -176.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.33 -68.02 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.016 0.436 . . . . 0.0 111.195 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.55 -10.46 59.45 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.087 0.47 . . . . 0.0 110.612 -172.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.943 HG21 HG12 ' A' ' 61' ' ' VAL . 51.7 m -78.8 -35.8 43.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 174.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 mtpt -80.64 -17.31 51.65 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.514 176.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 55' ' ' LEU . 3.8 mm? -63.93 -60.16 3.61 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.127 170.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -176.02 116.86 0.13 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.603 0.24 . . . . 0.0 110.848 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.943 HG12 HG21 ' A' ' 57' ' ' THR . 9.2 p -155.0 31.37 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.515 0.674 . . . . 0.0 110.501 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.657 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.4 m -107.84 121.65 61.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 O-C-N 121.761 -0.587 . . . . 0.0 111.901 -174.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -76.2 -57.49 1.39 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.218 174.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.749 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 65.9 Cg_endo -104.18 -138.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.768 2.979 . . . . 0.0 113.596 -167.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.468 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.8 m-20 -72.2 12.01 0.5 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.895 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.56 -74.59 0.39 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.561 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -70.28 153.12 43.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.249 -0.475 . . . . 0.0 110.386 176.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.58 36.69 2.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.384 0.611 . . . . 0.0 110.645 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.749 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 8.5 p80 -72.37 79.88 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.535 0.683 . . . . 0.0 111.045 175.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -86.94 -60.38 2.0 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.085 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.78 -62.26 6.3 Favored Glycine 0 CA--C 1.507 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 113.115 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -59.14 -23.54 62.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.09 64.95 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.272 0.558 . . . . 0.0 110.769 178.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.745 ' HE2' HG13 ' A' ' 91' ' ' VAL . 32.0 mmmt -80.3 -32.5 38.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.823 177.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.48 -39.9 94.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.685 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -63.49 -42.81 98.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.628 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.04 -37.78 72.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.611 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.1 mtm -69.92 -32.13 70.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.601 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.431 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 16.9 tptm -93.25 -10.32 36.01 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.822 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.486 ' HB3' HD23 ' A' ' 8' ' ' LEU . 75.7 m-70 -141.96 89.74 2.21 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 122.076 -0.39 . . . . 0.0 110.85 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 127.35 -68.17 0.54 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.793 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.43 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -106.34 140.85 38.62 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.851 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.37 159.65 29.35 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -61.6 -49.83 75.03 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.744 -164.765 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 7.0 t -60.14 -28.7 68.11 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.959 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.7 tpt -79.86 -46.24 17.21 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.48 0.657 . . . . 0.0 109.735 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.585 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -57.65 -35.78 70.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.805 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.6 mp0 -73.12 -25.17 60.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.594 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.0 mm-40 -75.65 -23.54 56.3 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 172.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.635 ' O ' HG13 ' A' ' 94' ' ' ILE . 36.3 tp -84.98 -41.98 15.35 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.255 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.745 HG13 ' HE2' ' A' ' 74' ' ' LYS . 35.1 m -57.6 -35.81 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -66.22 -44.12 84.73 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.232 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.4 mp -62.11 -44.18 98.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.606 173.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.635 HG13 ' O ' ' A' ' 90' ' ' LEU . 39.2 mt -51.89 -47.06 41.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-O 120.716 0.293 . . . . 0.0 110.526 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.53 -36.6 73.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.923 0.392 . . . . 0.0 110.641 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.59 -42.32 7.87 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 119.979 -1.105 . . . . 0.0 112.004 -173.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.418 ' HB2' ' HB ' ' A' ' 114' ' ' VAL . 55.2 m -73.23 -41.44 63.73 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.499 ' HG2' HG12 ' A' ' 114' ' ' VAL . 24.1 mm-40 -56.68 -38.73 72.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.45 171.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -69.68 -42.73 73.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.755 0.312 . . . . 0.0 111.661 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.0 m -96.86 8.01 45.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.37 149.83 94.11 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 104' ' ' ASN . 50.1 Cg_exo -56.04 164.85 4.48 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.111 2.541 . . . . 0.0 112.265 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 38.63 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.437 2.758 . . . . 0.0 113.212 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 102' ' ' PRO . 5.2 m-20 -99.45 104.98 16.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.718 176.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.83 87.05 4.71 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.4 t0 -112.05 104.23 12.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.279 -174.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -35.69 -76.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 124.595 1.184 . . . . 0.0 113.787 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.1 t -94.99 -15.59 23.41 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.559 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 1.9 mmm -86.02 -22.99 26.98 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -168.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.726 ' HD3' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.57 -38.6 81.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 122.069 0.938 . . . . 0.0 110.076 -175.367 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.797 HG21 HD12 ' A' ' 112' ' ' ILE . 0.6 OUTLIER -56.27 -16.86 6.1 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.101 -1.409 . . . . 0.0 112.291 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.797 HD12 HG21 ' A' ' 111' ' ' THR . 1.8 mp -91.17 -36.74 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -58.72 -37.1 75.42 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.199 176.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.605 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 4.8 m -80.71 -32.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.656 0.741 . . . . 0.0 109.971 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.57 -48.93 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.746 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.0 ptt? -69.18 -13.65 62.53 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.366 177.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.869 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 52.5 t -73.64 -31.75 63.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.758 173.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.449 ' HA ' HG12 ' A' ' 93' ' ' ILE . 74.2 t80 -74.17 -47.1 38.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.173 177.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.444 ' HD3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.45 -23.99 63.74 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 118.492 -1.283 . . . . 0.0 110.163 -178.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.869 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 25.0 ttpt -56.73 -54.09 50.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.017 0.437 . . . . 0.0 110.314 166.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -58.73 -48.81 79.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.539 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.428 HG22 ' N ' ' A' ' 123' ' ' HIS . 10.7 tt -58.44 -30.13 40.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 CA-C-N 118.361 0.528 . . . . 0.0 110.762 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.428 ' N ' HG22 ' A' ' 122' ' ' ILE . 6.2 m170 -71.28 -32.52 68.77 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.662 ' HE3' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.82 -33.72 74.3 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.433 0.635 . . . . 0.0 109.783 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.9 -36.97 84.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.516 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 64.64 -79.25 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.828 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 3.0 p-90 -93.71 -171.83 2.71 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.595 -176.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.6 p -99.4 126.06 38.96 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.766 0.317 . . . . 0.0 111.006 -178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.92 161.38 18.94 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.887 2.391 . . . . 0.0 112.582 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.57 133.76 34.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.932 -176.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.95 160.4 14.41 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.045 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -94.26 159.42 15.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 54.8 tp -119.51 123.19 43.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.949 0.404 . . . . 0.0 111.632 -174.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 2.8 m -78.15 119.61 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.071 172.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 11.3 mm -88.35 116.79 30.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 110.162 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -98.49 112.81 4.56 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.924 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -83.37 99.14 9.86 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 41.8 t -100.54 108.65 23.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.988 -176.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.7 tp -148.69 93.6 2.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.987 174.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -104.7 16.32 26.24 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.504 0.668 . . . . 0.0 109.967 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.488 ' HG3' HG21 ' A' ' 142' ' ' VAL . 7.8 tp10 -104.57 135.87 45.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.868 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.488 HG21 ' HG3' ' A' ' 141' ' ' GLU . 41.5 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.412 -178.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.468 ' HA ' ' OD1' ' A' ' 132' ' ' ASP . 32.2 p . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.486 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 36.9 Cg_exo -60.54 -21.42 68.48 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.987 2.458 . . . . 0.0 112.761 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -50.79 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.851 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.2 tt -83.16 -9.85 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.345 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.486 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.1 ttt -66.32 -28.66 68.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.244 0.545 . . . . 0.0 109.887 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -83.6 100.24 10.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.754 172.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.507 ' HB2' HD21 ' A' ' 10' ' ' ASN . 17.5 m120 -61.8 137.8 58.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.524 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.2 mt -54.18 -34.53 60.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.201 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.6 p -62.16 -40.75 97.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.277 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.507 HD21 ' HB2' ' A' ' 7' ' ' ASN . 56.9 m-80 -77.12 -30.45 55.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -68.21 -55.34 12.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -57.56 -82.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 170.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.19 36.35 35.93 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.804 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -69.37 -49.62 53.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.198 0.499 . . . . 0.0 110.383 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.506 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -153.8 105.39 2.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.488 178.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 54.7 ttp -75.47 -21.78 57.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.254 0.55 . . . . 0.0 110.194 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -63.03 -23.91 67.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.716 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.666 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 21.0 pt20 -84.56 -25.69 28.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.335 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.0 m -75.25 -35.45 61.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.481 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.09 -49.5 74.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.209 -178.096 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -70.62 -43.09 69.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.424 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.666 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.5 tm-20 -62.0 -44.29 97.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.966 -175.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 23' ' ' LEU . 15.2 mt -81.98 -13.65 57.14 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.637 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.0 m 57.64 38.36 27.69 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.091 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.602 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 19.2 mt -51.01 120.94 14.66 Favored Pre-proline 0 N--CA 1.465 0.325 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.093 -174.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.495 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.3 Cg_exo -69.05 154.46 70.53 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.165 1.91 . . . . 0.0 111.036 174.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.62 ' HA ' HG23 ' A' ' 30' ' ' VAL . 6.3 p-10 -65.63 -27.34 68.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.678 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -64.64 -40.52 95.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 109.566 174.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.625 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.3 t -72.85 -50.1 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.234 -177.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.62 HG23 ' HA ' ' A' ' 27' ' ' ASP . 16.8 m -54.98 -30.75 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 120.876 0.369 . . . . 0.0 110.21 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.21 -51.53 63.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.554 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -70.62 -39.22 73.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.453 0.644 . . . . 0.0 109.748 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 2.7 tm? -51.25 -54.35 26.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.576 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.24 9.66 0.07 Allowed 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -66.67 104.27 1.26 Allowed 'General case' 0 C--N 1.345 0.404 0 CA-C-N 120.332 1.423 . . . . 0.0 109.483 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -86.49 -20.16 28.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.512 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -90.27 142.32 27.84 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.439 0.638 . . . . 0.0 110.894 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.602 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -80.64 65.73 5.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.092 -171.858 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -62.39 -27.4 69.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.656 170.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.5 t70 63.09 70.66 0.54 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.593 0.711 . . . . 0.0 109.563 -172.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.4 p90 -95.63 163.15 13.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.082 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.8 t -87.97 121.64 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.56 ' HB3' HG23 ' A' ' 112' ' ' ILE . 43.4 tpp -76.45 104.68 7.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.474 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 p -110.13 -4.79 15.59 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.76 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -96.4 131.45 42.94 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 110.443 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 8.8 mpt_? -73.02 -23.9 60.67 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.87 -171.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.625 ' HB2' HG11 ' A' ' 29' ' ' VAL . 3.8 mm? -78.16 -18.12 55.95 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.055 0.455 . . . . 0.0 109.928 -177.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.532 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -85.16 -55.81 3.86 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -175.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.44 -48.32 2.94 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.939 165.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.7 m -64.12 -42.02 97.01 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.143 0.971 . . . . 0.0 111.667 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.532 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.1 mm -63.77 -29.74 48.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.963 0.411 . . . . 0.0 111.34 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -135.8 44.49 2.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.933 0.397 . . . . 0.0 111.362 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.539 ' SG ' HD12 ' A' ' 55' ' ' LEU . 24.6 p -94.27 -36.15 12.12 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.539 HD12 ' SG ' ' A' ' 54' ' ' CYS . 8.6 mp -56.41 -69.67 0.14 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -170.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.75 -8.8 59.73 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.061 0.458 . . . . 0.0 110.777 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.589 ' HA ' HG12 ' A' ' 61' ' ' VAL . 55.8 m -80.47 -35.16 35.23 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.297 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.479 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 16.9 mmmt -77.64 -21.84 51.63 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.4 173.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.476 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.9 mt -65.05 -65.84 0.62 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.814 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.16 119.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.589 HG12 ' HA ' ' A' ' 57' ' ' THR . 10.6 p -178.4 34.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.613 0.72 . . . . 0.0 111.13 -177.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.649 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.7 m -102.24 118.78 49.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.953 -1.092 . . . . 0.0 111.256 -173.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.16 -56.01 14.33 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.265 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.609 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 8.7 Cg_endo -95.01 -139.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.009 2.473 . . . . 0.0 112.854 -171.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.524 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 3.8 m-20 -76.27 11.18 1.63 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.587 -176.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.8 -75.41 0.4 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.523 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.609 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.9 p-10 -75.33 159.3 31.62 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.03 -0.585 . . . . 0.0 111.158 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.598 HD23 HD21 ' A' ' 67' ' ' ASN . 4.6 mm? 68.95 43.24 1.18 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.255 0.55 . . . . 0.0 111.967 174.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.649 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 6.7 p80 -83.34 76.0 9.94 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.476 0.655 . . . . 0.0 110.693 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -86.86 -61.93 1.62 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.814 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.15 -52.8 51.2 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.619 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -56.94 -34.68 68.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.286 . . . . 0.0 111.579 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.12 -36.15 74.6 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.184 0.516 . . . . 0.0 111.224 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.42 ' N ' ' HD2' ' A' ' 74' ' ' LYS . 21.1 mmmt -79.82 -35.18 38.78 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 33.3 t70 -64.18 -35.44 80.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.648 173.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.495 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 52.0 t80 -62.26 -35.27 78.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.485 176.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.21 72.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.856 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -68.2 -39.05 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.639 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.637 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 34.3 pttt -93.29 -5.95 48.58 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.227 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.637 ' CD2' ' HG3' ' A' ' 79' ' ' LYS . 66.6 m-70 -136.06 88.9 2.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.629 0.252 . . . . 0.0 110.75 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.22 -75.09 0.36 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.802 172.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -99.56 132.59 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.896 0.379 . . . . 0.0 111.331 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.462 ' OD2' HG21 ' A' ' 85' ' ' THR . 6.5 p-10 -79.21 172.36 13.91 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.62 -45.68 77.48 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -164.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.744 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 11.3 t -53.66 -40.69 66.1 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.439 ' HE3' ' OD1' ' A' ' 83' ' ' ASP . 58.9 mtm -82.24 -38.22 24.81 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.111 0.482 . . . . 0.0 109.701 -174.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -58.67 -37.58 76.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.165 172.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.76 -24.93 59.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.997 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.744 ' HG2' ' O ' ' A' ' 85' ' ' THR . 66.0 mm-40 -77.88 -23.49 48.77 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.532 ' O ' HG13 ' A' ' 94' ' ' ILE . 64.1 tp -88.3 -48.26 7.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.293 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 17.1 m -57.22 -38.13 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -172.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -68.14 -43.38 78.45 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.389 0.614 . . . . 0.0 110.363 -175.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.793 HG23 ' HB2' ' A' ' 117' ' ' CYS . 1.7 mp -61.8 -43.01 96.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.713 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.6 mt -55.64 -47.05 79.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.223 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -65.67 -34.71 78.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.505 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.71 -60.19 2.23 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.389 -169.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.766 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 8.8 p -74.01 -27.31 60.9 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.041 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.579 ' CB ' HG12 ' A' ' 114' ' ' VAL . 2.1 tm-20 -65.27 -38.25 89.71 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 118.576 -1.25 . . . . 0.0 109.783 171.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -64.74 -43.29 93.82 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.878 176.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -103.54 26.12 8.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.912 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.62 155.61 92.57 Favored Pre-proline 0 C--O 1.235 0.328 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.502 ' C ' ' H ' ' A' ' 104' ' ' ASN . 53.3 Cg_exo -53.69 164.99 1.95 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.003 2.468 . . . . 0.0 112.482 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.79 31.24 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.499 2.799 . . . . 0.0 113.169 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.502 ' H ' ' C ' ' A' ' 102' ' ' PRO . 4.6 m-20 -122.17 94.79 4.41 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.578 176.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.38 92.88 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.404 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.2 t70 -91.01 104.59 17.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.324 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 18.1 tttp -34.73 -74.35 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -167.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 27.7 t -90.82 -9.72 45.41 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.846 -0.533 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.404 ' HB2' ' OD1' ' A' ' 106' ' ' ASP . 3.0 mmm -87.74 -22.04 24.82 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -168.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.636 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -55.12 -45.85 75.57 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.703 0.763 . . . . 0.0 110.82 -173.196 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.636 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -53.97 -14.91 1.15 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.114 -1.403 . . . . 0.0 113.112 177.544 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.56 HG23 ' HB3' ' A' ' 43' ' ' MET . 1.7 mp -92.02 -39.06 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.667 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 15.5 t70 -58.42 -38.48 77.51 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 175.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.82 ' HA ' ' SG ' ' A' ' 117' ' ' CYS . 3.6 m -82.5 -34.07 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 CA-C-O 122.2 1.0 . . . . 0.0 110.347 -176.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.74 -43.38 90.22 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.72 173.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.667 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 22.5 ptt? -68.36 -20.01 64.68 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.301 -0.96 . . . . 0.0 112.111 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.82 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 1.4 m -66.85 -30.5 70.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 118.844 0.747 . . . . 0.0 109.228 170.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.05 -46.36 57.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.556 ' HE2' ' HB2' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.58 -21.97 62.62 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.57 177.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.814 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.22 -48.87 77.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 169.245 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.4 -52.12 66.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.09 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.423 HD11 HG21 ' A' ' 122' ' ' ILE . 0.4 OUTLIER -56.95 -35.68 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 117.726 0.239 . . . . 0.0 110.906 177.793 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -72.72 -17.57 61.6 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.07 -35.02 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 122.022 -0.424 . . . . 0.0 110.576 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 82.2 mt -73.23 -39.56 65.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 54.6 -90.7 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -61.69 103.68 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.994 -170.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.41 ' HB ' ' HB2' ' A' ' 131' ' ' MET . 6.8 m -124.11 100.46 36.33 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.387 171.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.54 -85.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.929 2.419 . . . . 0.0 113.638 -172.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -110.21 28.19 8.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.234 0.54 . . . . 0.0 110.259 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.41 ' HB2' ' HB ' ' A' ' 128' ' ' VAL . 84.6 mtp -80.53 54.67 2.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.942 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.468 ' OD1' ' HA ' ' A' ' 1' ' ' SER . 19.2 t70 -148.99 105.27 3.52 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.795 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.418 ' O ' ' HD2' ' A' ' 2' ' ' PRO . 60.3 tp -79.93 86.77 5.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.214 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 7.2 p -73.2 142.0 15.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.391 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.77 126.35 66.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.005 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -102.46 135.62 12.37 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.907 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -77.82 138.09 38.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.889 0.376 . . . . 0.0 111.061 -178.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.7 t -94.8 131.85 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.667 ' H ' HD23 ' A' ' 139' ' ' LEU . 2.6 pt? -92.29 148.57 22.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.2 0.524 . . . . 0.0 111.68 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -104.53 -76.17 0.6 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 170.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 67.88 156.4 0.12 Allowed 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.958 0.787 . . . . 0.0 112.671 167.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 4.7 p . . . . . 0 C--O 1.25 1.087 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.515 179.045 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -89.13 6.1 4.68 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.769 2.312 . . . . 0.0 113.243 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -51.62 -74.17 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.776 HD11 ' HB2' ' A' ' 82' ' ' ALA . 27.3 mm -91.03 -16.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.005 0.431 . . . . 0.0 111.89 177.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.5 tpt -69.73 -34.81 74.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -100.27 105.32 16.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.431 ' OD1' ' HB2' ' A' ' 9' ' ' SER . 6.1 t-20 -61.55 112.57 2.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.868 -174.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 8' ' ' LEU . 2.4 pt? -64.57 -23.22 67.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.433 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.431 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m -63.65 -40.23 96.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.057 0.456 . . . . 0.0 109.84 175.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.95 -30.14 58.55 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.64 -51.97 43.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -56.44 -79.48 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.642 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.81 39.85 40.38 Favored Glycine 0 C--N 1.346 1.137 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.338 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.502 ' HB3' ' HZ2' ' A' ' 14' ' ' LYS . 2.5 mmmp? -62.79 -42.45 99.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.863 0.332 . . . . 0.0 111.665 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.716 ' H ' HD23 ' A' ' 55' ' ' LEU . . . -144.55 105.01 4.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.059 0.456 . . . . 0.0 111.403 -177.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttm -75.45 -42.11 54.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.263 0.554 . . . . 0.0 110.76 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -63.36 -22.66 67.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.644 -175.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -88.0 -25.37 23.17 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.92 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.495 ' O ' HD21 ' A' ' 23' ' ' LEU . 14.7 m -71.91 -33.85 68.63 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 170.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -58.88 -55.28 37.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.911 175.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.1 -44.45 65.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.039 -174.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.681 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 19.6 tp10 -64.59 -39.27 93.43 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.713 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 4.4 mm? -82.43 -19.71 38.44 Favored 'General case' 0 CA--C 1.514 -0.435 0 O-C-N 122.213 -0.305 . . . . 0.0 110.479 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m 61.63 46.76 6.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -168.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HG ' ' HB2' ' A' ' 23' ' ' LEU . 20.5 mt -62.72 121.59 68.91 Favored Pre-proline 0 N--CA 1.453 -0.32 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.067 -170.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.586 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 24.0 Cg_exo -61.54 149.67 88.72 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.115 1.877 . . . . 0.0 110.427 176.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -59.97 -35.16 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.744 0.306 . . . . 0.0 110.973 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.3 m -69.16 -39.4 78.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.507 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.673 HG11 ' OD2' ' A' ' 45' ' ' ASP . 80.7 t -74.23 -52.97 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.719 -177.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.538 HG12 ' N ' ' A' ' 31' ' ' ALA . 9.9 p -57.53 -37.02 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.175 0.512 . . . . 0.0 110.273 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.538 ' N ' HG12 ' A' ' 30' ' ' VAL . . . -65.4 -51.33 61.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.221 177.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -71.78 -23.46 61.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.054 0.455 . . . . 0.0 110.716 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.63 -50.75 69.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.455 ' CE2' HG23 ' A' ' 30' ' ' VAL . 10.0 m-85 -77.28 10.61 2.36 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -57.54 130.49 46.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -72.46 -37.18 68.58 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -171.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 45.1 p90 -92.34 131.69 37.33 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.415 178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.413 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -89.38 73.31 7.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.546 0.689 . . . . 0.0 110.57 -178.129 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.486 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 36.3 t70 -42.7 -33.32 0.71 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.7 t0 67.2 51.27 0.93 Allowed 'General case' 0 C--N 1.348 0.531 0 CA-C-O 122.186 0.993 . . . . 0.0 109.715 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.486 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -91.62 178.03 6.04 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.159 174.431 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.421 ' O ' HG23 ' A' ' 44' ' ' THR . 25.7 t -83.33 117.93 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.682 ' HE2' HG13 ' A' ' 112' ' ' ILE . 29.4 ttp -67.65 92.85 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.185 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.421 HG23 ' O ' ' A' ' 42' ' ' VAL . 66.5 p -95.91 -8.78 33.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.527 -174.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.673 ' OD2' HG11 ' A' ' 29' ' ' VAL . 10.7 t70 -97.08 134.58 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.267 0.556 . . . . 0.0 111.503 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.605 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 6.2 mpt_? -76.31 -21.1 56.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.119 -174.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.586 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 3.9 mm? -79.64 -15.23 57.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.212 -176.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.41 -61.87 1.73 Allowed 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -176.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.766 ' HA3' HD12 ' A' ' 112' ' ' ILE . . . -42.45 -48.01 5.75 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.402 168.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 m -67.27 -44.46 79.26 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.581 1.191 . . . . 0.0 111.823 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.42 36.95 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.015 -0.428 . . . . 0.0 111.701 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.92 -29.37 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.426 ' O ' ' HB ' ' A' ' 57' ' ' THR . 23.3 t-20 -146.25 70.81 1.23 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.406 0.622 . . . . 0.0 110.707 175.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 58' ' ' LYS . 8.9 p -98.36 -41.77 7.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.901 174.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.716 HD23 ' H ' ' A' ' 15' ' ' ALA . 1.7 tm? -55.87 -66.0 0.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.057 0.456 . . . . 0.0 111.068 -176.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -82.75 -16.38 48.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.584 -169.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.482 HG21 ' CG2' ' A' ' 61' ' ' VAL . 23.7 m -84.16 -39.62 19.19 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.788 174.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.681 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 22.8 mmtt -81.62 -2.55 50.6 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.063 -0.398 . . . . 0.0 111.567 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 9.8 mt -64.99 -67.65 0.42 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.505 166.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -178.9 101.33 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.114 0.259 . . . . 0.0 110.978 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.482 ' CG2' HG21 ' A' ' 57' ' ' THR . 30.4 m -148.95 50.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-O 121.35 0.595 . . . . 0.0 111.169 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.636 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 5.9 m -99.9 120.58 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.85 -0.531 . . . . 0.0 110.915 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.456 ' H ' ' HB2' ' A' ' 69' ' ' HIS . 1.8 t70 -75.2 -57.73 1.66 Allowed Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.628 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 19.4 Cg_endo -98.68 -139.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.237 2.624 . . . . 0.0 113.058 -168.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.406 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 4.0 m-20 -72.63 10.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.244 -176.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.81 -70.02 0.52 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.703 HD21 HD21 ' A' ' 68' ' ' LEU . 2.5 p-10 -75.09 154.43 37.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.86 -0.67 . . . . 0.0 111.468 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.703 HD21 HD21 ' A' ' 67' ' ' ASN . 4.6 mm? 68.99 33.78 3.34 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.695 172.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.636 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.1 p80 -79.68 69.87 6.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.914 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.569 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 2.5 p-80 -85.67 -33.24 21.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.249 177.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.41 -62.84 4.75 Favored Glycine 0 CA--C 1.511 -0.216 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.382 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -57.52 -30.49 65.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.61 -0.295 . . . . 0.0 111.532 -178.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.73 -36.39 65.18 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.178 0.514 . . . . 0.0 111.372 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 24.4 mmmt -80.37 -35.03 35.96 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.18 -38.8 90.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.587 ' CZ ' ' HB1' ' A' ' 56' ' ' ALA . 48.8 t80 -56.11 -43.42 78.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.923 175.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.55 -34.02 71.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.969 0.414 . . . . 0.0 111.212 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.452 ' HE1' ' HB3' ' A' ' 87' ' ' ALA . 67.0 mtt -74.6 -34.86 62.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.669 -179.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.893 ' HE2' ' HA ' ' A' ' 79' ' ' LYS . 9.5 mmpt? -91.37 -10.13 42.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.551 -0.459 . . . . 0.0 111.138 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -143.5 93.87 2.53 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 128.83 -75.5 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.543 174.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.776 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -98.36 151.41 20.56 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.537 0.208 . . . . 0.0 110.743 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.59 ' OD2' HG21 ' A' ' 85' ' ' THR . 1.4 p-10 -91.84 172.95 8.12 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -58.04 -38.08 75.6 Favored 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -170.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 8.0 t -62.44 -35.95 80.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.526 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.434 ' O ' HD11 ' A' ' 90' ' ' LEU . 59.1 mtp -83.05 -39.12 21.63 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -176.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.505 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.63 -34.41 72.76 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.59 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.793 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.36 -23.61 54.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.484 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.8 mm-40 -77.81 -25.04 48.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.8 mp -85.37 -46.26 11.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.409 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.793 HG22 ' HA ' ' A' ' 88' ' ' GLN . 6.3 m -58.62 -32.33 45.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.38 -44.46 75.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 0.0 110.184 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.747 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.7 mp -68.76 -41.97 82.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.274 177.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 65.3 mt -56.98 -49.26 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 0.0 110.026 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -72.52 -36.36 68.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.276 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.44 -45.96 5.97 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.051 -172.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.539 ' SG ' HG23 ' A' ' 93' ' ' ILE . 83.5 m -70.74 -39.86 73.06 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.878 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.6 tm-20 -63.34 -38.23 90.36 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.222 0.465 . . . . 0.0 110.449 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -68.22 -36.04 78.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 110.939 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.3 m -96.69 7.79 45.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 111.272 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.19 144.6 84.82 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.1 -176.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 35.4 Cg_exo -61.14 146.12 97.95 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.347 2.032 . . . . 0.0 110.124 174.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 37.9 Cg_exo -57.07 91.14 0.05 OUTLIER 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.967 2.445 . . . . 0.0 113.256 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -125.97 93.47 3.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 175.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -81.3 63.45 5.63 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 0.0 110.927 -175.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.775 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.3 t70 -124.18 112.36 16.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.213 172.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -34.09 -55.0 0.5 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.7 t -88.19 -30.55 19.66 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.032 0.833 . . . . 0.0 112.294 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.775 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 73.2 mmm -65.28 -36.25 83.5 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.659 ' HG3' ' H ' ' A' ' 111' ' ' THR . 5.6 ptpt -57.79 -48.39 79.83 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.818 0.818 . . . . 0.0 110.346 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.659 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -57.46 -10.66 1.52 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.602 174.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.766 HD12 ' HA3' ' A' ' 49' ' ' GLY . 1.1 mp -89.84 -41.36 13.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.754 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 4.4 m-20 -59.66 -35.49 74.53 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.362 174.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.629 HG21 ' HA ' ' A' ' 111' ' ' THR . 7.1 m -80.76 -35.49 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.046 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.408 ' N ' HG23 ' A' ' 114' ' ' VAL . . . -60.41 -51.57 68.92 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.337 0.589 . . . . 0.0 111.472 177.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.754 ' HE3' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -68.97 -25.17 64.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.251 179.538 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 48.5 t -68.57 -27.03 65.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.745 175.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.747 ' HB2' HG22 ' A' ' 93' ' ' ILE . 66.3 t80 -74.36 -44.31 52.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.285 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 1.2 pttp -70.49 -29.72 66.32 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.174 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.689 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.34 -56.18 23.01 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.958 0.409 . . . . 0.0 110.322 169.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -61.95 -42.28 98.93 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 175.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.1 -33.67 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 118.488 0.586 . . . . 0.0 111.078 175.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -71.59 -32.22 67.8 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.244 -0.285 . . . . 0.0 111.659 174.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.2 tttt -68.56 -35.84 77.95 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.317 0.58 . . . . 0.0 110.116 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 81.7 mt -76.55 -0.48 23.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.431 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 65.12 177.06 0.2 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-O 121.469 0.652 . . . . 0.0 111.596 -177.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -110.48 120.38 42.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.873 -170.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.39 116.23 66.17 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.292 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.69 137.56 59.55 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.736 2.291 . . . . 0.0 112.488 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -88.07 136.84 32.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 70.1 mtm -68.02 -41.91 81.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.504 0.192 . . . . 0.0 111.011 -174.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.83 -178.34 0.14 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.871 0.732 . . . . 0.0 111.858 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.521 HD11 ' N ' ' A' ' 134' ' ' VAL . 1.3 tm? 178.59 147.67 0.18 Allowed 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.521 ' N ' HD11 ' A' ' 133' ' ' LEU . 5.6 p -56.15 101.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.56 0.695 . . . . 0.0 110.561 177.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.592 ' H ' HD12 ' A' ' 135' ' ' ILE . 0.2 OUTLIER -71.62 18.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.669 -176.478 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . 0.422 ' H ' ' C ' ' A' ' 134' ' ' VAL . . . 95.27 89.95 1.74 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.793 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -64.61 133.09 51.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 171.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 51.2 t -44.82 120.61 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 O-C-N 123.969 0.793 . . . . 0.0 111.857 -172.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.87 139.2 38.37 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.145 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -148.64 140.06 23.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.659 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -82.55 -47.31 12.3 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.275 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.111 179.79 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 110.723 -0.103 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.97 -22.55 55.31 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.461 2.107 . . . . 0.0 111.348 177.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.46 -65.98 0.47 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.289 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 tp -72.46 -15.2 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-O 121.126 0.489 . . . . 0.0 111.188 178.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.2 ttt -71.22 -24.94 62.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.91 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -100.33 94.08 6.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.908 174.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -64.12 138.93 58.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.278 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.7 -43.07 84.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.755 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.4 m -62.3 -36.56 82.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.98 -36.88 62.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.011 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.93 -55.82 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.956 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -48.97 -72.41 0.05 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.24 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.36 29.61 46.86 Favored Glycine 0 C--N 1.347 1.141 0 C-N-CA 121.039 -0.6 . . . . 0.0 113.772 -177.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -85.89 -37.26 19.32 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.14 0.47 . . . . 0.0 110.718 -178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.58 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.38 56.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.088 0.471 . . . . 0.0 111.314 -177.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.1 ttm -72.38 -38.48 68.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.155 0.502 . . . . 0.0 110.12 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.72 -34.43 74.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.905 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -90.42 -25.35 20.41 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.53 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 12.3 p -74.95 -33.0 61.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.89 ' HA ' HD23 ' A' ' 25' ' ' LEU . 9.9 tptm -57.11 -50.86 71.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.611 172.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -70.3 -42.65 71.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.44 -36.04 82.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.538 0.209 . . . . 0.0 111.339 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 50' ' ' CYS . 11.3 mt -81.03 -3.75 52.86 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.753 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.1 t 65.45 27.83 11.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.811 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.89 HD23 ' HA ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -55.01 119.86 25.34 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.012 176.506 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -75.01 156.86 42.98 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.774 2.316 . . . . 0.0 111.435 174.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.647 ' HA ' HG23 ' A' ' 30' ' ' VAL . 12.6 p-10 -66.73 -22.59 66.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.17 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 p -68.48 -39.76 81.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.0 110.761 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.56 HG11 ' OD2' ' A' ' 45' ' ' ASP . 93.1 t -70.35 -50.87 42.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.379 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.647 HG23 ' HA ' ' A' ' 27' ' ' ASP . 17.3 m -58.9 -33.6 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.393 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -50.45 67.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.499 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.43 -37.14 86.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.313 0.577 . . . . 0.0 110.01 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mt -57.91 -54.83 42.53 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.056 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -74.88 8.99 2.09 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -176.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -63.24 130.96 46.77 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.349 0.522 . . . . 0.0 110.771 -178.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -74.47 -31.68 62.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.142 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 -81.23 118.0 22.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.778 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' O ' ' HD3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -81.44 72.95 8.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.351 0.596 . . . . 0.0 111.754 -177.207 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.531 ' HB3' ' CD2' ' A' ' 41' ' ' TYR . 18.7 t70 -44.94 -44.64 9.94 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 173.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.509 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 20.6 m-20 75.01 70.9 0.09 Allowed 'General case' 0 C--N 1.35 0.607 0 CA-C-O 121.522 0.677 . . . . 0.0 110.489 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.531 ' CD2' ' HB3' ' A' ' 39' ' ' ASP . 9.1 p90 -117.73 176.68 5.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.455 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.407 ' O ' HG23 ' A' ' 44' ' ' THR . 6.2 t -92.16 121.06 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.68 ' HE2' HD11 ' A' ' 52' ' ' ILE . 41.6 ttm -62.25 100.93 0.19 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.519 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 42' ' ' VAL . 67.9 p -99.32 -23.64 15.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.56 ' OD2' HG11 ' A' ' 29' ' ' VAL . 10.3 t70 -83.82 134.21 34.72 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.5 0.667 . . . . 0.0 111.484 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.792 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 9.5 mpt_? -74.88 -21.87 58.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.465 -175.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.454 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.7 mm? -79.5 -13.04 59.83 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.445 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -61.69 1.89 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -41.07 -48.48 4.34 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 114.901 -1.045 . . . . 0.0 114.293 169.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.584 ' HB3' HD13 ' A' ' 23' ' ' LEU . 15.4 m -68.75 -38.86 80.42 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.49 1.145 . . . . 0.0 111.947 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.31 -23.97 67.49 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.68 HD11 ' HE2' ' A' ' 43' ' ' MET . 70.1 mt -61.96 -37.34 78.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 121.264 0.554 . . . . 0.0 110.622 177.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.459 ' N ' HD21 ' A' ' 53' ' ' ASN . 0.0 OUTLIER -132.88 85.47 2.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.803 0.811 . . . . 0.0 110.076 -178.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 24.4 p -119.01 -46.34 2.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.504 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.58 HD11 ' H ' ' A' ' 15' ' ' ALA . 1.5 tt -58.76 -67.07 0.4 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.041 0.448 . . . . 0.0 111.382 -171.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.547 ' HA ' HD11 ' A' ' 59' ' ' LEU . . . -82.04 -14.72 55.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 110.889 -173.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.459 HG21 HG11 ' A' ' 61' ' ' VAL . 1.4 m -83.04 -35.39 25.8 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.783 ' HZ3' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.56 -16.31 49.02 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.199 -0.601 . . . . 0.0 110.069 174.373 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.547 HD11 ' HA ' ' A' ' 56' ' ' ALA . 24.9 mt -64.63 -64.99 0.74 Allowed 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 121.164 -0.215 . . . . 0.0 111.206 172.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -174.61 126.2 0.31 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 -177.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.478 ' CG2' ' HA ' ' A' ' 73' ' ' ALA . 14.6 p 179.89 38.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 122.348 1.07 . . . . 0.0 109.193 -173.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.683 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 25.2 m -105.17 118.56 52.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.198 -172.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -69.37 -56.01 8.96 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.534 175.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.702 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.3 Cg_endo -98.28 -142.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 123.537 2.825 . . . . 0.0 113.524 -172.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.405 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -72.13 -2.98 20.6 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.866 -174.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.58 -66.22 0.46 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -174.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.702 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.1 p-10 -71.37 153.73 42.1 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.683 -0.759 . . . . 0.0 110.842 178.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.416 ' HB2' HD21 ' A' ' 67' ' ' ASN . 0.1 OUTLIER 68.47 32.92 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.567 169.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.683 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.7 p80 -74.61 69.18 1.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.864 0.84 . . . . 0.0 110.841 175.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.507 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 64.2 t60 -86.95 -60.79 1.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.858 -176.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.52 -53.45 45.85 Favored Glycine 0 N--CA 1.461 0.365 0 C-N-CA 121.223 -0.513 . . . . 0.0 113.096 -175.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -56.05 -34.05 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.633 0.254 . . . . 0.0 111.484 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.478 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -74.61 -33.95 62.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.146 0.498 . . . . 0.0 110.744 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.628 ' O ' ' HG3' ' A' ' 78' ' ' MET . 23.2 mmmt -79.04 -35.32 42.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.35 -40.2 95.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.004 174.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -59.7 -36.74 77.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.531 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -36.25 75.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.901 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.628 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 50.8 mtt -67.78 -33.35 74.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.958 0.409 . . . . 0.0 110.782 -177.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -91.27 -10.54 41.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.026 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -145.72 94.4 2.49 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.541 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.4 -60.92 0.41 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.065 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.3 147.28 26.14 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.133 -0.534 . . . . 0.0 110.474 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.572 ' HB2' ' HB3' ' A' ' 86' ' ' MET . 3.6 m-20 -75.72 146.92 39.74 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 173.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.801 ' HG3' HE21 ' A' ' 88' ' ' GLN . 0.2 OUTLIER -67.53 -47.29 70.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.15 -39.67 44.17 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.87 169.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.572 ' HB3' ' HB2' ' A' ' 83' ' ' ASP . 0.8 OUTLIER -82.82 -37.88 23.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -173.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.541 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -60.79 -41.03 94.8 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.993 174.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.801 HE21 ' HG3' ' A' ' 84' ' ' GLU . 2.6 mp0 -71.29 -27.21 63.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.653 -173.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.405 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -84.77 -22.07 29.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.742 173.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.7 tt -86.12 -42.53 13.81 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.06 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.497 HG11 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -58.76 -32.98 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 122.944 0.498 . . . . 0.0 111.948 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.73 -42.29 97.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.015 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.562 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -62.59 -41.49 92.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.012 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 34.2 mt -56.94 -47.65 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.385 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -67.62 -35.98 79.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.293 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.2 -46.65 5.8 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.183 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.717 ' HB2' HG12 ' A' ' 114' ' ' VAL . 43.7 m -73.4 -35.2 65.82 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.783 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 6.1 mt-10 -66.12 -37.24 85.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.864 0.756 . . . . 0.0 111.029 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -64.02 -42.24 97.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.869 0.366 . . . . 0.0 110.473 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.9 m -100.36 22.62 11.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.208 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.6 156.81 70.47 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.063 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.411 ' C ' ' H ' ' A' ' 104' ' ' ASN . 94.6 Cg_exo -44.41 141.4 5.22 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.892 2.395 . . . . 0.0 111.819 177.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.02 22.97 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.872 2.381 . . . . 0.0 113.666 -171.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.411 ' H ' ' C ' ' A' ' 102' ' ' PRO . 3.5 m-20 -115.21 94.14 4.6 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -74.31 97.7 3.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.194 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.526 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 8.7 t70 -89.3 115.52 26.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.854 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -29.72 -63.35 0.13 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.18 1.55 . . . . 0.0 113.627 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 9.9 t -96.89 -12.84 22.96 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -175.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.792 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 3.1 mmm -86.75 -26.18 24.32 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -170.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.679 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -54.36 -44.89 72.58 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.076 0.941 . . . . 0.0 110.852 -171.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.679 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 14.8 t -57.84 -13.2 3.92 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.806 -1.543 . . . . 0.0 113.092 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -91.17 -37.97 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.48 -38.27 77.26 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.79 175.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.717 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -78.95 -36.28 18.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 121.283 0.563 . . . . 0.0 110.265 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.47 -46.83 88.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.645 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.635 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 21.9 ptt? -69.57 -17.61 63.57 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.628 176.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.63 -30.1 64.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.756 0.788 . . . . 0.0 109.071 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -82.06 -39.77 22.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.669 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.939 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.6 -24.27 63.64 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 118.833 -1.147 . . . . 0.0 110.279 177.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.635 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.16 -54.99 27.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.991 160.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.54 -49.61 76.78 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 178.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.939 HG23 ' HA ' ' A' ' 119' ' ' LYS . 8.7 tt -57.77 -34.44 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 122.009 -0.432 . . . . 0.0 110.961 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.601 ' N ' HG22 ' A' ' 122' ' ' ILE . 4.6 m-70 -70.45 -29.5 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 177.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -63.04 -34.5 77.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.3 mt -72.04 -11.24 60.67 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.182 173.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 0.415 ' HB3' ' H ' ' A' ' 127' ' ' TRP . 0.9 OUTLIER 67.49 -162.84 0.22 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.043 0.537 . . . . 0.0 111.986 -179.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . 0.415 ' H ' ' HB3' ' A' ' 126' ' ' ASN . 7.2 m95 -71.32 97.62 1.62 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.622 -172.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.419 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 29.4 m -83.25 140.34 42.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.852 173.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 13.6 Cg_exo -69.63 75.83 1.13 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 123.057 2.504 . . . . 0.0 112.395 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.625 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.7 OUTLIER -129.61 110.23 11.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.404 178.316 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.625 ' HG2' ' O ' ' A' ' 130' ' ' ASN . 12.7 ptt? 61.99 156.96 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.631 1.172 . . . . 0.0 112.208 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -92.62 -173.59 3.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.415 -175.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -102.31 120.92 41.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 8.5 m -88.56 113.52 25.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.161 0.505 . . . . 0.0 111.489 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.1 mp -83.32 90.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -142.93 69.92 0.42 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.702 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -81.79 -76.93 0.23 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 75.9 t 65.51 117.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.386 0.612 . . . . 0.0 111.062 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.43 16.62 9.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.794 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -153.89 154.99 34.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.312 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -88.44 165.81 14.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.248 0.987 0 O-C-N 124.572 1.17 . . . . 0.0 112.24 179.54 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.59 -21.21 70.39 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.227 2.618 . . . . 0.0 112.512 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.483 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.62 -69.19 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.624 179.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -77.83 -10.7 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.075 0.464 . . . . 0.0 111.215 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.833 ' HE2' ' HA ' ' A' ' 5' ' ' MET . 2.6 tpt -65.33 -39.72 92.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.119 0.485 . . . . 0.0 110.065 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -82.41 103.48 12.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.743 174.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -63.74 148.43 49.18 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.46 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.459 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 9.7 mp -58.92 -52.65 64.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.088 -176.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.9 m -63.3 -33.28 75.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.738 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -72.43 -37.27 68.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.556 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.35 -54.73 13.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.853 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 24.8 m-85 -44.73 -69.11 0.15 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.646 171.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.73 33.93 63.91 Favored Glycine 0 C--N 1.342 0.899 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.05 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -67.46 -53.6 27.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 117.598 0.699 . . . . 0.0 109.537 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.469 ' HB2' ' HB2' ' A' ' 18' ' ' GLN . . . -144.79 88.17 1.89 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.106 0.479 . . . . 0.0 111.09 176.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.0 ttm -69.97 -35.53 74.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.09 -36.55 84.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.548 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 15' ' ' ALA . 34.2 mt-30 -89.47 -25.27 21.55 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.687 -0.805 . . . . 0.0 111.452 -172.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -68.83 -35.69 77.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 170.051 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.908 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -61.55 -46.81 88.35 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.922 175.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -69.79 -43.62 71.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.867 -176.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -70.58 -33.61 71.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -174.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.645 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 7.0 mt -86.97 -4.5 59.18 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.434 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m 59.09 43.42 17.46 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.359 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.908 HD22 ' HA ' ' A' ' 20' ' ' LYS . 4.3 mm? -49.77 120.62 11.37 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.9 174.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.625 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 12.3 Cg_exo -72.67 154.4 54.49 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 121.941 1.761 . . . . 0.0 110.814 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.67 ' HA ' HG23 ' A' ' 30' ' ' VAL . 15.0 p-10 -64.13 -27.36 69.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.826 -176.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 m -65.93 -36.26 82.87 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.122 0.487 . . . . 0.0 110.381 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.9 t -82.35 -41.04 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.476 -176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.67 HG23 ' HA ' ' A' ' 27' ' ' ASP . 27.4 m -58.87 -33.19 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.838 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.98 -51.95 53.86 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.539 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.9 -37.2 86.52 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.7 tp -51.48 -51.74 52.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.63 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -67.84 11.56 0.14 Allowed 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.54 HD21 ' HB3' ' A' ' 39' ' ' ASP . 27.5 p-10 -59.67 111.11 1.31 Allowed 'General case' 0 C--N 1.346 0.429 0 CA-C-N 120.522 1.51 . . . . 0.0 111.382 -174.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -95.46 -2.66 48.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.925 0.393 . . . . 0.0 111.249 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 p90 -91.14 160.51 15.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.139 177.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.807 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -73.26 80.23 1.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 122.074 0.94 . . . . 0.0 110.619 176.614 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.54 ' HB3' HD21 ' A' ' 35' ' ' ASN . 4.7 p-10 -44.82 -53.33 7.58 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.9 p30 49.02 33.06 4.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.595 0.758 . . . . 0.0 111.147 -169.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.56 177.37 4.87 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.69 -176.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.429 HG12 ' HE2' ' A' ' 119' ' ' LYS . 22.4 t -101.71 136.11 35.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.898 -179.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.671 ' HE2' HG13 ' A' ' 112' ' ' ILE . 51.8 ttp -70.75 101.46 2.1 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -97.72 -40.82 8.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.257 -173.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.449 ' OD1' ' HB2' ' A' ' 47' ' ' LEU . 8.5 t70 -86.44 120.17 27.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.355 0.598 . . . . 0.0 112.052 -173.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.699 ' HG2' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -44.21 -42.28 6.4 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 114.493 -1.23 . . . . 0.0 113.155 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.699 HD22 ' HG2' ' A' ' 46' ' ' ARG . 3.7 mm? -64.67 -19.47 65.75 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 122.262 -0.274 . . . . 0.0 111.45 -175.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.523 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.08 -59.79 2.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -178.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.54 -47.46 2.95 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-N 115.097 -0.956 . . . . 0.0 114.467 166.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.402 ' HB3' HD13 ' A' ' 23' ' ' LEU . 30.0 m -63.41 -43.76 96.6 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.489 1.144 . . . . 0.0 111.22 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.52 -23.79 66.29 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.523 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.0 mm -63.86 -34.24 66.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.108 0.48 . . . . 0.0 110.594 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -140.1 63.18 1.48 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.187 0.518 . . . . 0.0 111.277 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.427 ' CB ' HD12 ' A' ' 23' ' ' LEU . 28.7 p -114.54 -38.65 3.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 177.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.575 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.3 tt -62.72 -55.63 24.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.551 -170.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.1 -13.69 58.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.079 0.466 . . . . 0.0 110.42 -173.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.566 HG21 ' CG1' ' A' ' 61' ' ' VAL . 36.7 m -82.97 -35.89 25.56 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.54 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.755 ' HZ3' ' HB3' ' A' ' 58' ' ' LYS . 9.0 mtpm? -81.53 -16.03 53.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.265 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.2 mt -65.62 -65.32 0.69 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.255 170.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -175.7 121.31 0.19 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.706 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.566 ' CG1' HG21 ' A' ' 57' ' ' THR . 11.5 p -177.28 36.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.477 1.132 . . . . 0.0 109.12 -178.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.586 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.2 m -103.88 117.52 49.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.42 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -54.41 7.54 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.956 177.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.682 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -96.41 -145.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.911 2.407 . . . . 0.0 112.906 -173.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.403 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.1 m-20 -76.71 10.14 2.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.376 -176.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.72 -69.56 0.52 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.682 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.3 p-10 -69.12 149.42 48.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.712 -0.744 . . . . 0.0 111.36 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.58 HD23 HD21 ' A' ' 67' ' ' ASN . 4.0 mm? 69.7 31.69 3.5 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 16.5 p-80 -74.74 68.86 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.314 0.578 . . . . 0.0 110.878 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -86.39 -49.02 7.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.926 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.15 -53.7 43.54 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.582 -174.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -62.01 -27.67 69.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -36.64 73.22 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.672 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 32.1 mmmt -80.03 -35.65 36.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.74 -37.58 88.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.402 173.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -63.07 -35.96 81.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.172 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.23 -37.05 74.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.61 ' HE3' ' HG2' ' A' ' 84' ' ' GLU . 81.0 mtp -74.44 -39.01 62.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.358 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -82.98 -12.34 57.38 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.804 0.335 . . . . 0.0 110.292 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -144.4 94.56 2.58 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.342 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.83 -64.94 0.47 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.046 -1.073 . . . . 0.0 113.428 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.23 138.34 41.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.032 0.444 . . . . 0.0 111.833 -175.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.597 ' OD2' HG21 ' A' ' 85' ' ' THR . 1.0 OUTLIER -84.05 174.46 10.27 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 172.246 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.61 ' HG2' ' HE3' ' A' ' 78' ' ' MET . 30.1 mt-10 -62.22 -35.38 78.72 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.47 -167.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.801 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 12.7 t -61.76 -38.37 87.75 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.751 -177.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 65.4 mtm -81.32 -39.38 25.24 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -174.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -60.58 -39.74 89.17 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.279 173.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.8 mp0 -73.73 -26.4 60.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.709 -177.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.801 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.7 mm-40 -78.46 -23.56 46.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.619 177.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.642 ' O ' HG13 ' A' ' 94' ' ' ILE . 3.4 mm? -85.26 -49.04 8.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.961 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 19.9 m -57.99 -39.39 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.14 -43.06 71.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.869 0.366 . . . . 0.0 110.536 -176.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.701 HG23 ' SG ' ' A' ' 97' ' ' CYS . 3.2 mm -63.43 -42.12 95.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.335 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.672 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.8 mt -51.55 -47.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.622 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.1 m170 -70.87 -36.46 72.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.166 0.508 . . . . 0.0 110.639 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.55 -49.5 4.6 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.334 -172.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.72 ' HB2' HG12 ' A' ' 114' ' ' VAL . 57.9 m -71.39 -35.76 71.16 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.867 -177.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.672 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 1.3 mt-10 -63.92 -37.73 88.48 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.603 0.638 . . . . 0.0 110.88 172.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.22 -35.87 82.21 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.041 0.448 . . . . 0.0 110.546 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.5 m -107.43 25.51 11.36 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.472 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -87.32 149.64 47.41 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -175.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.16 149.24 81.6 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.364 2.043 . . . . 0.0 110.288 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -66.45 71.87 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.857 2.372 . . . . 0.0 113.146 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -99.73 91.66 4.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -81.2 77.27 8.11 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.962 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.717 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.7 t70 -145.3 128.43 16.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.733 174.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HE2' ' HB3' ' A' ' 107' ' ' LYS . 13.4 ttpt -29.25 -55.87 0.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 125.024 1.453 . . . . 0.0 114.508 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.43 ' CB ' ' HB2' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -93.72 -16.97 23.69 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.519 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.717 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 90.3 mmm -74.3 -32.14 62.76 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 121.841 -0.537 . . . . 0.0 111.731 -172.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.763 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -62.71 -49.53 74.71 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.692 0.758 . . . . 0.0 109.853 178.013 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.763 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.06 -14.21 6.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.468 175.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.671 HG13 ' HE2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -89.27 -39.71 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.493 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 12.2 t70 -62.94 -35.38 79.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.484 177.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.72 HG12 ' HB2' ' A' ' 97' ' ' CYS . 15.8 m -79.42 -38.15 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.025 0.441 . . . . 0.0 110.168 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -60.44 -49.1 78.92 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-O 121.544 0.688 . . . . 0.0 111.304 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 25.0 ptt? -69.58 -19.85 63.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.06 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.841 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 8.5 t -72.79 -24.17 60.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.455 ' HE1' ' HB3' ' A' ' 89' ' ' GLN . 57.6 t80 -77.76 -40.58 40.41 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.424 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.767 ' HA ' HG23 ' A' ' 122' ' ' ILE . 2.2 pttp -67.82 -29.62 68.82 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 118.725 -1.19 . . . . 0.0 110.348 176.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.841 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.99 -54.62 44.89 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.625 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.412 ' HG3' HD13 ' A' ' 93' ' ' ILE . 14.4 mm-40 -58.71 -52.03 67.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.844 176.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.767 HG23 ' HA ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -54.91 -36.63 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.463 ' N ' HG22 ' A' ' 122' ' ' ILE . 57.7 m170 -70.86 -32.15 69.07 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.302 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -71.18 -33.94 70.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.214 0.53 . . . . 0.0 110.393 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 90.2 mt -66.23 -33.79 76.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.546 173.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 125' ' ' LEU . 53.4 m-80 75.92 123.44 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.583 0.753 . . . . 0.0 111.912 177.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 26.0 m95 50.04 -158.15 0.08 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.061 177.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.525 HG23 ' H ' ' A' ' 130' ' ' ASN . 7.6 p -131.46 129.14 22.13 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.087 -175.187 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 2.8 Cg_exo -76.69 15.81 1.02 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.545 2.83 . . . . 0.0 112.968 -179.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.525 ' H ' HG23 ' A' ' 128' ' ' VAL . 22.2 t-20 -115.99 125.9 53.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.239 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 44.8 mtm -98.36 102.58 14.37 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.323 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -102.77 105.35 15.76 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.144 0.497 . . . . 0.0 110.285 175.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 46.8 tp -65.22 -30.02 70.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.404 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.92 117.35 6.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.45 176.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -117.51 115.94 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.229 -178.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -55.57 133.63 49.64 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.67 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -66.11 139.79 58.18 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.4 p -137.58 141.25 39.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.878 0.371 . . . . 0.0 110.83 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.476 HD21 ' H ' ' A' ' 141' ' ' GLU . 0.5 OUTLIER -118.31 129.08 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 177.85 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -83.46 -14.47 52.43 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.476 ' H ' HD21 ' A' ' 139' ' ' LEU . 46.3 mt-10 -105.23 149.82 25.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 0.0 110.967 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.4 m . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.281 179.203 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 120.828 0.347 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -83.73 -0.94 9.91 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.742 2.294 . . . . 0.0 112.515 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -51.1 -70.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.784 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.631 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -78.98 -9.48 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 121.149 0.499 . . . . 0.0 111.183 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 26.0 ttt -71.48 -30.09 65.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.33 -178.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.648 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 1.8 tpmt? -89.28 103.84 16.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.768 176.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.554 ' HB2' ' HB3' ' A' ' 10' ' ' ASN . 6.3 m120 -84.85 127.57 34.21 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.745 HD22 ' HB3' ' A' ' 80' ' ' HIS . 7.3 mp -60.13 -52.99 63.0 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -176.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -64.57 -26.83 68.58 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.447 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.554 ' HB3' ' HB2' ' A' ' 7' ' ' ASN . 27.9 t-20 -75.62 -34.31 60.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.494 177.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -74.5 -55.4 5.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.943 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -50.08 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.94 45.28 81.5 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 120.669 -0.777 . . . . 0.0 113.051 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.53 -60.24 3.95 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.829 0.347 . . . . 0.0 110.988 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -150.5 93.76 2.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.54 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 ttp -74.07 -31.01 62.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.68 -30.42 63.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.252 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -88.06 -26.21 22.66 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.037 -175.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 82.8 m -75.71 -31.04 59.49 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 170.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 1.0 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 23.4 tptp -56.18 -50.11 72.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.327 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.775 -178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.511 ' CD ' ' HZ1' ' A' ' 58' ' ' LYS . 22.4 tt0 -69.74 -37.29 76.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -173.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.983 ' HB2' HD11 ' A' ' 25' ' ' LEU . 16.0 mt -86.22 -6.28 59.01 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.132 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.7 t 59.53 43.82 15.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.435 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 1.0 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 10.3 mp -50.14 124.87 18.14 Favored Pre-proline 0 N--CA 1.47 0.559 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.313 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.545 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 11.1 Cg_exo -71.86 151.26 56.73 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.256 1.971 . . . . 0.0 110.072 170.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.529 ' HA ' HG23 ' A' ' 30' ' ' VAL . 1.5 p30 -66.29 -26.01 67.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.847 0.356 . . . . 0.0 111.218 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 p -65.76 -32.91 74.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.07 0.462 . . . . 0.0 110.7 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.498 HG11 ' HB2' ' A' ' 47' ' ' LEU . 23.8 t -79.04 -42.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.37 -177.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 27' ' ' ASP . 34.8 m -59.61 -29.22 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.126 0.489 . . . . 0.0 109.745 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.65 -52.71 41.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.6 176.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.97 -36.31 81.91 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.323 0.583 . . . . 0.0 109.747 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.8 tp -47.09 -55.67 7.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.253 173.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -66.58 10.07 0.14 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -65.78 116.18 6.7 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 120.393 1.451 . . . . 0.0 109.895 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -78.26 -28.79 47.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.289 -176.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -82.66 98.08 8.85 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -174.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -91.35 67.5 5.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.984 -174.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -63.47 13.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.06 70.47 0.65 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 119.087 0.858 . . . . 0.0 110.096 -169.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -103.05 171.07 7.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.574 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.8 t -90.67 113.56 26.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.211 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.547 ' O ' HG22 ' A' ' 112' ' ' ILE . 40.4 ttm -79.25 95.5 5.67 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.809 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.1 p -93.22 -18.0 23.03 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -84.88 133.81 34.3 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.811 0.815 . . . . 0.0 110.517 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.509 ' HE ' ' CG ' ' A' ' 106' ' ' ASP . 9.9 mpt_? -68.98 -31.49 70.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.084 -1.416 . . . . 0.0 109.769 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.545 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.4 mm? -75.11 -14.88 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.04 -58.29 2.75 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.443 ' O ' HG22 ' A' ' 52' ' ' ILE . . . -38.64 -45.01 1.91 Allowed Glycine 0 CA--C 1.534 1.261 0 CA-C-N 114.919 -1.037 . . . . 0.0 114.655 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.466 ' HB3' HD12 ' A' ' 23' ' ' LEU . 4.1 m -76.24 -44.92 35.27 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.473 1.136 . . . . 0.0 112.247 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.4 -23.87 63.78 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 49' ' ' GLY . 14.7 tt -71.72 -19.86 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 0.0 110.945 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -144.08 85.24 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.229 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 23.9 t -121.76 -45.24 2.29 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.55 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.25 -49.07 78.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.97 0.414 . . . . 0.0 111.51 -174.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.53 -15.67 51.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.962 0.41 . . . . 0.0 110.921 -174.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.508 HG21 HG12 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -83.78 -34.63 24.72 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.396 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.511 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 43.2 mtpt -82.92 -12.92 56.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.199 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.27 -64.09 0.95 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.888 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -175.05 111.7 0.13 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.508 HG12 HG21 ' A' ' 57' ' ' THR . 8.1 p -176.0 32.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-O 121.327 0.584 . . . . 0.0 111.497 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.58 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.8 m -109.65 117.58 54.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.28 -0.888 . . . . 0.0 111.659 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.574 ' HB2' ' HA ' ' A' ' 69' ' ' HIS . 0.1 OUTLIER -65.73 -59.68 8.75 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.485 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 27.6 Cg_endo -104.87 -139.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.52 2.813 . . . . 0.0 112.607 -171.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.508 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -72.13 -0.3 11.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.153 -177.652 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.78 -75.7 0.27 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.995 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.7 p-10 -70.06 152.68 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.084 -0.558 . . . . 0.0 111.637 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.49 HD23 HD21 ' A' ' 67' ' ' ASN . 4.6 mm? 70.98 27.67 3.34 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.504 0.722 . . . . 0.0 112.325 174.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.58 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 4.4 p80 -74.65 68.12 1.62 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 111.119 171.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -87.49 -31.66 19.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.395 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.6 -63.33 3.77 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.953 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.575 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 7.9 m-80 -55.26 -25.43 33.66 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 122.913 0.485 . . . . 0.0 112.087 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.27 -38.09 75.01 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.38 0.61 . . . . 0.0 110.291 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.49 ' HE3' HD13 ' A' ' 94' ' ' ILE . 59.9 mmtt -81.5 -36.43 29.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.762 177.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.575 ' HB3' ' HA ' ' A' ' 72' ' ' ASN . 11.2 t70 -60.58 -40.67 92.58 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.361 174.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -60.83 -42.41 97.69 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.443 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.39 -30.25 68.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.434 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 84.7 mtp -74.23 -40.88 62.12 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.598 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 13.6 ptpt -94.28 -7.89 40.65 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.456 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.745 ' HB3' HD22 ' A' ' 8' ' ' LEU . 42.5 m-70 -139.91 90.82 2.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.36 176.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.38 -75.74 0.42 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.646 173.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.631 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -96.91 149.8 21.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.513 ' OD2' HG21 ' A' ' 85' ' ' THR . 0.2 OUTLIER -84.37 169.4 14.65 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 173.092 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -67.05 -38.22 85.46 Favored 'General case' 0 N--CA 1.411 -2.405 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.148 -168.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.75 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.7 OUTLIER -62.21 -33.51 74.69 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.08 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 7.4 tpt -84.56 -39.98 18.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -57.98 -38.97 77.05 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.535 172.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -71.67 -23.83 61.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.197 -178.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.75 ' HG2' ' O ' ' A' ' 85' ' ' THR . 9.0 mm-40 -77.21 -25.75 52.05 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.478 ' HG ' HD12 ' A' ' 94' ' ' ILE . 22.1 tp -86.95 -44.91 11.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.274 -175.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.431 HG12 ' O ' ' A' ' 87' ' ' ALA . 26.7 m -57.36 -34.46 46.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.281 -175.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.69 -44.07 78.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.776 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -65.46 -41.06 90.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.854 175.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.49 HD13 ' HE3' ' A' ' 74' ' ' LYS . 86.4 mt -55.45 -48.24 77.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.681 -177.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -72.28 -35.26 68.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.897 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.9 -43.71 7.52 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.879 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.63 ' SG ' HG23 ' A' ' 93' ' ' ILE . 63.0 m -72.79 -34.54 66.98 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 121.398 -0.121 . . . . 0.0 110.789 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.562 ' N ' HG13 ' A' ' 114' ' ' VAL . 36.9 tt0 -57.41 -38.38 74.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.819 0.343 . . . . 0.0 110.732 170.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -64.77 -43.23 93.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.168 175.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.1 m -99.0 25.17 6.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.841 0.353 . . . . 0.0 111.745 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 102' ' ' PRO . . . -76.09 148.21 81.04 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.606 178.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 23.9 Cg_exo -64.42 151.38 85.73 Favored 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.672 2.248 . . . . 0.0 111.871 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.4 Cg_exo -70.55 59.3 2.01 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -121.61 116.72 25.13 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -81.12 93.17 6.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.919 0.39 . . . . 0.0 111.249 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.698 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 6.2 m-20 -130.03 97.65 4.53 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.318 0.58 . . . . 0.0 110.152 170.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.487 ' HE3' ' HB3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -42.65 -49.05 5.58 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 176.321 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.06 -24.14 28.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.871 1.214 . . . . 0.0 112.16 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.698 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 2.4 mmm -85.54 -26.72 26.02 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.534 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.1 OUTLIER -56.78 -45.95 81.8 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.737 0.779 . . . . 0.0 111.311 -170.46 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.534 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.93 -14.06 5.62 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.288 177.363 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.547 HG22 ' O ' ' A' ' 43' ' ' MET . 3.7 mp -90.13 -37.14 9.21 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 176.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -60.09 -35.31 74.93 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.518 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.562 HG13 ' N ' ' A' ' 98' ' ' GLU . 16.5 m -81.26 -34.97 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.79 84.44 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.243 0.544 . . . . 0.0 111.653 174.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.548 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.523 179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.503 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 43.2 t -73.02 -23.12 60.57 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.863 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.776 ' HB2' HG22 ' A' ' 93' ' ' ILE . 34.8 t80 -79.76 -46.56 16.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.534 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.17 -25.21 64.24 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 118.499 -1.28 . . . . 0.0 109.345 177.6 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.548 ' HE3' ' O ' ' A' ' 116' ' ' MET . 3.5 ttmt -54.02 -55.69 24.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.166 169.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.446 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 27.4 mm-40 -59.11 -40.52 85.62 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.509 173.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.55 HD13 HD11 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -57.23 -35.23 47.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 118.467 0.576 . . . . 0.0 111.349 176.949 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -72.46 -31.67 65.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.115 0.484 . . . . 0.0 111.135 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -71.0 -22.35 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.556 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.55 HD11 HD13 ' A' ' 122' ' ' ILE . 96.6 mt -71.05 5.48 2.04 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.727 176.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 10.5 p30 46.82 -160.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.337 1.055 . . . . 0.0 112.57 -178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -75.25 -60.73 2.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 -174.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.62 145.53 0.1 Allowed Pre-proline 0 CA--C 1.537 0.452 0 O-C-N 123.94 0.775 . . . . 0.0 110.971 -176.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -63.6 100.36 0.28 Allowed 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.231 1.954 . . . . 0.0 111.246 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -90.77 170.41 10.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.377 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 25.2 ptm -93.38 150.21 20.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.084 -176.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -83.92 162.02 20.63 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 175.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 27.7 tp -129.15 46.27 2.66 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.46 112.27 18.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.548 179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.9 mp -80.22 133.14 30.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.063 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -69.82 89.02 0.3 Allowed Glycine 0 N--CA 1.451 -0.342 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 174.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.03 140.78 55.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 122.617 0.367 . . . . 0.0 111.75 -173.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.4 p -54.54 139.7 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.831 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 10.5 tt -101.27 -26.89 13.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.47 178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.48 124.83 22.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.035 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -130.71 -70.53 0.61 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.791 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.355 -0.831 . . . . 0.0 109.901 178.719 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.471 0.594 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.3 Cg_exo -58.18 -21.75 53.16 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.044 2.496 . . . . 0.0 112.518 -178.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -49.25 -68.25 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.823 177.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.8 tp -78.15 -14.3 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.115 0.483 . . . . 0.0 111.447 -177.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.412 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.7 mmm -80.15 -21.43 43.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.5 tttp -90.56 114.11 26.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -88.99 135.04 33.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.457 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.835 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.7 mp -58.03 -48.15 80.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.173 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.5 m -60.83 -37.02 80.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.004 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -70.54 -37.22 74.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.841 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -72.09 -56.75 5.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.406 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -58.7 -79.94 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.95 42.08 69.49 Favored Glycine 0 C--N 1.344 0.99 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.726 -171.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -81.9 -36.98 27.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.211 0.529 . . . . 0.0 110.528 -176.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.06 55.74 1.38 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.574 0.702 . . . . 0.0 109.638 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.43 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 53.9 tpp -69.77 -37.71 76.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.709 -177.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -54.09 -38.07 64.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.594 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.444 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 30.2 mt-30 -90.67 -27.24 19.14 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.346 -0.542 . . . . 0.0 111.67 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 9.1 p -76.83 -33.04 57.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.743 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 8.9 tptp -57.91 -49.69 75.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.75 172.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.91 -39.94 72.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.393 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 3.2 tm-20 -68.57 -39.27 81.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.201 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -77.37 -4.71 46.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.122 0.487 . . . . 0.0 110.385 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.2 m 65.43 36.3 6.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.504 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.743 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 18.2 mt -65.07 120.09 64.18 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.786 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.562 ' CD ' HD23 ' A' ' 47' ' ' LEU . 7.9 Cg_exo -73.95 163.41 36.96 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.838 2.359 . . . . 0.0 110.444 171.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -62.34 -32.32 73.07 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.408 -174.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -63.95 -52.9 57.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 111.447 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.717 HG22 HD21 ' A' ' 47' ' ' LEU . 59.1 t -70.14 -53.38 23.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.75 -175.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.446 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 9.9 p -59.9 -30.01 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.007 -176.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.84 -51.48 40.04 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.05 -34.58 78.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.661 0.743 . . . . 0.0 109.388 178.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -53.82 -38.73 64.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.612 171.214 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.441 ' CE2' HG21 ' A' ' 30' ' ' VAL . 19.6 m-85 -76.28 9.13 2.76 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -65.4 108.01 1.83 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.915 0.78 . . . . 0.0 109.89 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -71.27 -33.57 69.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.732 -175.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 25.9 m-90 -74.13 126.84 31.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.468 0.652 . . . . 0.0 110.294 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.742 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -75.99 69.9 2.64 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.808 -178.711 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.629 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 29.1 t70 -43.62 -23.96 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 176.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.1 t0 67.32 71.4 0.36 Allowed 'General case' 0 C--N 1.351 0.637 0 CA-C-N 118.97 0.804 . . . . 0.0 109.553 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.629 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.2 p90 -124.19 169.84 11.33 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.758 -177.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -90.21 132.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 35.9 ttp -68.95 93.19 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.477 0.656 . . . . 0.0 109.621 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.9 p -88.33 -40.65 13.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.737 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.659 ' OD2' HG11 ' A' ' 29' ' ' VAL . 24.1 t70 -80.96 117.74 21.84 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 122.246 1.022 . . . . 0.0 111.059 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.697 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.33 -37.39 62.27 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.066 -1.879 . . . . 0.0 111.792 172.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.717 HD21 HG22 ' A' ' 29' ' ' VAL . 28.3 tp -71.27 -18.06 62.44 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 -173.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.406 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -51.87 8.13 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.95 -46.03 1.7 Allowed Glycine 0 CA--C 1.531 1.073 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.212 165.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.9 m -68.87 -43.42 75.39 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.393 1.097 . . . . 0.0 109.596 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.58 -9.47 58.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.354 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 48' ' ' ALA . 55.9 mt -59.22 -36.17 61.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.05 0.452 . . . . 0.0 110.282 175.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -135.47 84.77 2.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.569 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.3 p -102.26 -45.51 5.1 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.9 -178.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.45 ' O ' HD23 ' A' ' 59' ' ' LEU . 61.9 tp -60.64 -57.02 14.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.267 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.22 -15.69 54.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.009 0.433 . . . . 0.0 110.762 -170.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.618 HG21 HG12 ' A' ' 61' ' ' VAL . 96.0 m -74.79 -34.0 62.35 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.556 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 14.8 mmmt -79.36 -25.85 42.16 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.435 177.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.45 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.1 mm? -65.42 -64.29 0.9 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.846 172.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -176.27 117.17 0.13 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.691 0.282 . . . . 0.0 110.776 -175.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.618 HG12 HG21 ' A' ' 57' ' ' THR . 11.2 p -166.43 32.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.239 1.019 . . . . 0.0 109.338 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.704 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 35.5 m -111.28 120.68 62.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.176 -174.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.19 -56.15 2.04 Favored Pre-proline 0 CA--C 1.533 0.318 0 O-C-N 122.277 -0.264 . . . . 0.0 111.43 175.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.663 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 10.9 Cg_endo -97.04 -146.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.155 2.57 . . . . 0.0 112.682 -173.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.477 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -74.56 11.76 0.94 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.788 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.77 -68.88 0.54 Allowed Glycine 0 C--N 1.317 -0.49 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.316 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.769 HD21 HD23 ' A' ' 68' ' ' LEU . 3.6 p-10 -70.0 149.5 47.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.43 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.769 HD23 HD21 ' A' ' 67' ' ' ASN . 4.0 mm? 68.69 31.73 4.45 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 173.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.704 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 13.3 p80 -73.9 72.6 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.583 0.706 . . . . 0.0 111.669 176.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -87.34 -47.52 8.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.044 -179.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.63 -59.07 11.51 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.89 -173.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -63.28 -24.18 67.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.29 -36.51 68.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.221 0.534 . . . . 0.0 110.378 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HE3' HG12 ' A' ' 91' ' ' VAL . 3.1 mmmp? -79.91 -33.37 39.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.891 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.634 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 20.9 t70 -64.23 -42.1 96.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.084 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -63.89 -39.52 94.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.82 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.7 -33.7 72.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.164 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.429 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 68.7 mtm -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.961 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 3.7 ptpp? -93.16 -14.16 27.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.867 -0.733 . . . . 0.0 111.583 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.835 ' HB3' HD21 ' A' ' 8' ' ' LEU . 47.5 m-70 -139.08 92.64 2.61 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.403 178.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.27 -75.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.579 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.22 146.22 30.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.579 0.228 . . . . 0.0 110.559 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.692 ' OD1' HG21 ' A' ' 85' ' ' THR . 2.5 p30 -87.54 174.71 8.31 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.343 0.592 . . . . 0.0 110.643 173.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -49.46 69.95 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.56 -166.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.75 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.1 t -62.76 -32.27 73.39 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.465 -175.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 72.0 mtp -79.59 -39.46 31.65 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.447 0.641 . . . . 0.0 109.53 -173.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.534 ' HB3' ' HZ3' ' A' ' 74' ' ' LYS . . . -63.14 -31.64 72.84 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.507 176.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.871 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -82.35 -19.61 38.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.8 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.75 ' HG2' ' O ' ' A' ' 85' ' ' THR . 75.4 mm-40 -78.58 -23.68 45.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.624 ' O ' HG13 ' A' ' 94' ' ' ILE . 24.9 tp -85.98 -43.86 12.82 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.006 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.871 HG22 ' HA ' ' A' ' 88' ' ' GLN . 2.8 m -57.67 -29.73 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -175.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -68.08 -43.02 79.51 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.265 0.555 . . . . 0.0 109.865 -178.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.579 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.01 -42.05 85.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.058 175.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.624 HG13 ' O ' ' A' ' 90' ' ' LEU . 27.2 mt -54.95 -47.59 76.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 CA-C-O 120.921 0.391 . . . . 0.0 110.174 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -70.22 -37.07 74.95 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.826 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.94 -48.39 5.2 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.277 -173.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.759 ' HB2' HG12 ' A' ' 114' ' ' VAL . 39.7 m -72.98 -37.42 67.05 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -67.36 -37.36 83.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 117.969 0.349 . . . . 0.0 110.494 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.34 -33.4 75.77 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.814 0.34 . . . . 0.0 110.577 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.7 m -97.73 8.11 45.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.324 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.24 155.51 79.44 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.885 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.487 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 59.6 Cg_exo -52.88 138.21 60.85 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.75 2.3 . . . . 0.0 111.977 176.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.7 Cg_exo -71.28 35.1 0.27 Allowed 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.592 2.861 . . . . 0.0 113.208 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 102' ' ' PRO . 52.5 t30 -95.94 119.47 34.49 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.97 96.03 4.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.435 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.937 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.5 t70 -144.38 119.03 9.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.346 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.511 ' HZ3' ' HB2' ' A' ' 107' ' ' LYS . 4.0 ttmp? -29.92 -71.83 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.074 1.484 . . . . 0.0 113.776 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.498 ' O ' HD11 ' A' ' 112' ' ' ILE . 81.6 m -88.79 -14.72 36.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -174.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.937 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -63.12 -42.62 99.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.703 0.683 . . . . 0.0 110.453 -178.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.724 ' HG3' ' H ' ' A' ' 111' ' ' THR . 0.6 OUTLIER -64.44 -49.97 69.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.651 0.738 . . . . 0.0 110.422 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.724 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -59.04 -13.4 6.6 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.913 175.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -88.3 -35.86 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.778 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 0.2 OUTLIER -59.81 -37.56 79.5 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.046 173.254 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.759 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.7 m -78.02 -38.29 24.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.733 178.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.07 -52.59 64.71 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 121.006 0.432 . . . . 0.0 111.739 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.778 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -69.4 -24.68 63.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.58 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.887 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 13.8 t -69.09 -25.43 64.42 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.594 0.712 . . . . 0.0 110.142 176.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.573 ' HA ' HG12 ' A' ' 93' ' ' ILE . 75.1 t80 -79.81 -43.09 23.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.133 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.421 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.6 pttp -68.12 -28.1 67.04 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.736 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.887 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.42 -54.95 41.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.709 0.29 . . . . 0.0 111.008 173.211 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.556 ' HG3' ' N ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -59.52 -47.59 84.94 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.346 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.556 ' N ' ' HG3' ' A' ' 121' ' ' GLU . 1.9 tt -59.85 -31.24 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 120.932 0.396 . . . . 0.0 110.943 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -70.6 -30.86 67.65 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 176.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -36.15 69.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.54 -38.49 77.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.407 174.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 65.3 t30 52.24 -110.09 0.49 Allowed 'General case' 0 CA--C 1.531 0.22 0 O-C-N 123.51 0.506 . . . . 0.0 109.731 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -138.16 135.13 35.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 169.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.7 t 62.62 83.09 0.21 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 110.708 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -88.43 119.89 1.19 Allowed 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.835 2.356 . . . . 0.0 111.764 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -94.96 106.41 18.39 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.168 0.508 . . . . 0.0 110.951 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 61.1 mtt -81.73 141.08 33.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.316 176.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -85.16 127.14 34.15 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.424 -176.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.8 tp -83.01 83.22 7.91 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.26 0.552 . . . . 0.0 109.971 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 47.6 t -81.51 137.78 20.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.538 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -143.49 98.91 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.362 0.601 . . . . 0.0 110.874 -178.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -87.31 160.67 32.07 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.355 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -106.89 151.1 25.7 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.9 m -116.33 105.0 17.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.462 0.648 . . . . 0.0 111.218 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.706 ' H ' HD23 ' A' ' 139' ' ' LEU . 0.6 OUTLIER -86.42 102.2 13.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.032 178.002 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -90.22 112.19 23.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.623 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.16 116.35 20.21 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.097 177.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 C--O 1.249 1.062 0 CA-C-O 117.876 -1.059 . . . . 0.0 112.542 -178.296 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.403 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 66.8 m . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 120.581 0.229 . . . . 0.0 110.801 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 24.9 Cg_endo -63.34 -21.36 71.59 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.416 2.077 . . . . 0.0 111.738 177.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -49.93 -69.56 0.11 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.934 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -78.19 -12.94 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.05 0.453 . . . . 0.0 111.495 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 74.5 mmm -79.5 -21.83 44.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 110.958 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -89.11 103.84 16.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.967 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -62.44 136.17 57.78 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.916 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.627 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.5 pt? -56.4 -42.96 78.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.843 178.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.756 ' HB3' HD13 ' A' ' 55' ' ' LEU . 50.8 m -61.44 -30.28 70.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -74.7 -31.66 61.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.083 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -75.6 -49.36 18.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.145 176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -46.7 -74.2 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 172.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.3 46.04 87.35 Favored Glycine 0 C--N 1.34 0.751 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.661 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.559 ' H ' HD23 ' A' ' 55' ' ' LEU . 87.9 tttt -67.76 -62.03 1.6 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 117.057 0.429 . . . . 0.0 110.987 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.87 102.83 3.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.551 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.4 mmt -70.65 -25.29 62.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.17 0.51 . . . . 0.0 110.168 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.45 -31.11 70.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.777 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -88.87 -25.63 22.05 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.85 -170.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.438 ' O ' HD21 ' A' ' 23' ' ' LEU . 99.7 m -74.25 -34.58 63.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.189 0.519 . . . . 0.0 109.764 173.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -62.2 -47.29 85.12 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.893 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -76.14 -48.15 21.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.678 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.82 -32.3 72.75 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -174.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.54 ' CB ' HD11 ' A' ' 25' ' ' LEU . 4.1 mm? -88.9 -17.42 29.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.667 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 60.61 36.25 19.77 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -170.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.784 HD23 HG12 ' A' ' 30' ' ' VAL . 2.0 tp -57.08 121.81 49.06 Favored Pre-proline 0 N--CA 1.456 -0.138 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.801 -172.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -68.54 155.67 68.22 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.694 2.263 . . . . 0.0 110.804 173.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.683 ' HA ' HG23 ' A' ' 30' ' ' VAL . 52.7 p30 -70.9 -20.53 62.49 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.587 -175.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 m -66.38 -37.52 85.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 109.876 173.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.641 HG11 ' OD2' ' A' ' 45' ' ' ASP . 61.7 t -73.58 -51.43 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.885 -177.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.784 HG12 HD23 ' A' ' 25' ' ' LEU . 35.5 m -57.42 -36.31 52.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 120.937 0.399 . . . . 0.0 110.931 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.62 -51.71 57.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.731 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.14 -25.25 60.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.144 0.497 . . . . 0.0 110.167 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.6 tp -56.59 -52.75 63.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.406 174.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -74.57 10.04 1.52 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -65.36 126.21 27.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.852 0.751 . . . . 0.0 111.184 -175.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -82.87 -35.05 26.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.349 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -72.73 134.25 44.92 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.005 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -77.54 67.76 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.217 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -43.69 -54.71 4.87 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 171.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.0 t70 64.63 70.35 0.49 Allowed 'General case' 0 C--N 1.347 0.472 0 CA-C-O 121.699 0.762 . . . . 0.0 109.919 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -125.59 178.66 5.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.158 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 62.0 t -83.69 128.88 38.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 51.0 ttm -68.03 92.44 0.38 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.253 0.549 . . . . 0.0 109.669 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.1 p -92.12 -32.63 15.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.493 -174.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.641 ' OD2' HG11 ' A' ' 29' ' ' VAL . 13.7 t70 -70.87 129.84 40.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.401 0.62 . . . . 0.0 111.227 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -75.2 -20.88 59.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.296 -175.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.589 ' HB3' HD13 ' A' ' 25' ' ' LEU . 3.4 mm? -78.34 -15.73 58.42 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.109 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.0 -62.49 1.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -177.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.74 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -41.3 -48.12 4.55 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 114.845 -1.071 . . . . 0.0 114.475 169.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.3 m -66.97 -42.63 84.81 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.541 1.171 . . . . 0.0 111.794 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.01 -18.83 65.6 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 48' ' ' ALA . 46.3 mm -54.67 -40.25 50.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.277 175.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -118.6 77.15 1.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.024 177.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 t -125.28 -46.72 1.77 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.278 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.756 HD13 ' HB3' ' A' ' 9' ' ' SER . 7.5 mp -66.77 -74.95 0.1 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.413 0.625 . . . . 0.0 111.743 -170.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.14 -3.22 54.41 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.326 0.584 . . . . 0.0 110.069 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.531 HG21 ' CG1' ' A' ' 61' ' ' VAL . 81.1 m -83.63 -35.99 24.2 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.354 173.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.438 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.1 mtpt -77.49 -15.52 59.25 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.056 172.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 tp -64.94 -66.41 0.55 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.529 172.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -176.22 121.26 0.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.531 ' CG1' HG21 ' A' ' 57' ' ' THR . 12.5 p -179.47 43.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.622 0.725 . . . . 0.0 111.655 -176.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.56 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.3 m -105.97 121.46 58.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 110.366 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.619 ' HA ' HD21 ' A' ' 72' ' ' ASN . 1.8 t70 -64.55 -55.21 31.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.794 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.687 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.5 Cg_endo -97.72 -138.85 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.233 2.622 . . . . 0.0 113.298 -172.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.495 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -71.28 -5.51 32.79 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.226 -173.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 140.27 -56.75 0.61 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -170.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.687 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.6 p-10 -84.32 149.47 26.03 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.085 -0.557 . . . . 0.0 111.029 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.46 46.43 1.03 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.34 0.591 . . . . 0.0 110.799 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.618 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -75.14 81.42 2.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.534 0.683 . . . . 0.0 111.32 178.678 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -86.0 -63.25 1.35 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.232 -175.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.32 -60.27 8.88 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 121.278 -0.487 . . . . 0.0 113.05 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.619 HD21 ' HA ' ' A' ' 63' ' ' ASP . 13.9 m-20 -55.49 -29.04 58.06 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.29 -37.18 66.32 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.056 0.455 . . . . 0.0 110.919 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.545 ' O ' ' HG3' ' A' ' 78' ' ' MET . 72.6 mmtt -79.33 -33.67 42.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.04 -39.98 95.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.379 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.48 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 42.4 t80 -63.65 -32.51 74.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.396 177.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.71 -32.94 71.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.651 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.545 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 55.0 mtt -69.39 -28.12 65.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.859 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HE3' ' HA ' ' A' ' 76' ' ' PHE . 49.3 mtmt -86.31 -15.65 39.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.065 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -145.58 96.0 2.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.664 0.269 . . . . 0.0 111.199 -176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.08 -62.99 0.51 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.396 -0.906 . . . . 0.0 112.48 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.545 ' HB3' ' HB2' ' A' ' 86' ' ' MET . . . -104.08 139.48 39.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.746 0.308 . . . . 0.0 111.032 -177.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.608 ' OD1' HG21 ' A' ' 85' ' ' THR . 0.9 OUTLIER -88.11 175.97 7.49 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.408 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -54.47 -38.36 66.3 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.747 -171.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.608 HG21 ' OD1' ' A' ' 83' ' ' ASP . 8.3 t -73.69 -25.09 60.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.497 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.719 ' HA ' HE21 ' A' ' 89' ' ' GLN . 54.0 mtt -84.62 -39.61 18.46 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.447 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -65.38 -39.26 92.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.352 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -76.61 -25.37 53.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.422 -174.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.719 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -83.1 -23.43 33.06 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.334 -0.547 . . . . 0.0 110.071 173.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.572 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.1 tt -82.97 -48.17 10.96 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.481 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.417 ' HA ' HD12 ' A' ' 94' ' ' ILE . 16.6 m -57.33 -36.19 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.883 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -65.77 -41.3 92.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.009 0.433 . . . . 0.0 110.568 -176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.567 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.4 mp -62.46 -42.59 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.694 176.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 90' ' ' LEU . 34.2 mt -56.97 -48.13 82.16 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.152 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -67.0 -34.69 78.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.208 0.528 . . . . 0.0 110.233 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -48.81 5.57 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.705 -172.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 11.7 m -74.82 -31.45 61.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.734 -0.651 . . . . 0.0 112.669 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.497 ' CG ' HG12 ' A' ' 114' ' ' VAL . 37.5 mt-10 -57.36 -37.15 72.16 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.328 0.967 . . . . 0.0 109.833 166.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.654 ' HZ2' ' HB2' ' A' ' 99' ' ' LYS . 0.5 OUTLIER -72.79 -43.53 62.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.8 m -97.68 15.51 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -81.06 154.38 72.51 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.467 0.175 . . . . 0.0 110.573 177.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.405 ' HB2' ' OD1' ' A' ' 104' ' ' ASN . 13.8 Cg_exo -69.45 163.12 39.23 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.831 2.354 . . . . 0.0 110.939 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.44 40.72 0.29 Allowed 'Trans proline' 0 CA--C 1.534 0.515 0 C-N-CA 123.17 2.58 . . . . 0.0 113.379 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.405 ' OD1' ' HB2' ' A' ' 102' ' ' PRO . 2.6 m-20 -83.07 93.69 7.65 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -81.57 94.48 6.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.984 0.421 . . . . 0.0 110.825 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.83 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 10.1 t70 -133.14 107.36 8.15 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -28.79 -58.74 0.13 Allowed 'General case' 0 N--CA 1.473 0.693 0 O-C-N 124.967 1.417 . . . . 0.0 114.59 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.22 -15.99 22.83 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.83 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 12.9 ttt -85.18 -25.49 27.36 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -167.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.601 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.17 -47.08 86.61 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.292 1.044 . . . . 0.0 110.741 -177.51 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.601 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -53.94 -14.33 0.99 Allowed 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.29 174.308 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.74 HD13 ' HA3' ' A' ' 49' ' ' GLY . 1.6 mp -91.95 -41.68 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.524 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 1.0 OUTLIER -62.78 -32.43 73.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.735 176.644 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.586 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -80.39 -35.21 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 CA-C-O 121.211 0.529 . . . . 0.0 110.143 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.75 78.09 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.812 0.815 . . . . 0.0 111.557 174.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.697 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.57 -19.34 64.47 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.845 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.586 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 6.6 t -69.48 -30.32 68.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.105 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.489 ' HA ' HG12 ' A' ' 93' ' ' ILE . 62.9 t80 -70.99 -43.38 68.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.844 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.56 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 0.9 OUTLIER -69.35 -29.63 67.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.95 -1.1 . . . . 0.0 110.501 176.322 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.697 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -56.1 -47.88 77.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.413 0.625 . . . . 0.0 109.97 168.091 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.47 ' HG2' HD12 ' A' ' 93' ' ' ILE . 9.4 tp10 -57.09 -50.0 74.15 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.595 176.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.439 HD11 HG21 ' A' ' 122' ' ' ILE . 0.4 OUTLIER -56.63 -31.26 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 120.629 0.252 . . . . 0.0 111.211 177.763 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.74 -32.09 67.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.656 ' O ' ' HD3' ' A' ' 124' ' ' LYS . 9.8 tmtt? -72.15 -27.9 62.9 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 92.8 mt -73.83 12.84 0.6 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.135 -0.938 . . . . 0.0 111.976 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -40.76 120.74 1.34 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.39 0.676 . . . . 0.0 112.115 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -80.05 28.85 0.28 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.395 -174.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.468 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 11.6 m -67.05 124.44 88.83 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.751 0.31 . . . . 0.0 110.969 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 17.5 Cg_exo -66.95 -56.96 0.21 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.769 2.312 . . . . 0.0 112.161 179.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 51.4 t30 68.17 -72.19 0.1 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.835 0.709 . . . . 0.0 111.394 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 26.0 mmt -105.9 171.94 7.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.75 0.31 . . . . 0.0 110.476 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -103.62 -177.05 3.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.346 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.7 mp 52.99 67.42 1.0 Allowed 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.741 0.651 . . . . 0.0 110.775 -179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.7 p -80.55 95.93 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.48 0.657 . . . . 0.0 110.888 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 28.9 mm 61.45 83.53 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.028 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.39 87.47 0.35 Allowed Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.238 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -127.72 103.41 7.28 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.6 p -127.92 126.37 66.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.177 0.513 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.9 tp -89.51 -67.24 0.85 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.379 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . 68.98 130.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.044 0.84 . . . . 0.0 111.961 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . 0.542 ' HG3' HG12 ' A' ' 142' ' ' VAL . 12.2 pt-20 -80.34 -29.1 37.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.47 178.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.542 HG12 ' HG3' ' A' ' 141' ' ' GLU . 7.6 p . . . . . 0 C--O 1.249 1.028 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.8 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 120.585 0.231 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 130' ' ' ASN . 19.3 Cg_exo -66.89 -19.54 52.36 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.855 2.37 . . . . 0.0 112.176 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -46.48 -66.12 0.45 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.492 HD11 ' HB3' ' A' ' 82' ' ' ALA . 8.3 tp -81.3 -10.33 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.915 0.388 . . . . 0.0 111.56 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.35 -23.69 57.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.127 0.489 . . . . 0.0 110.037 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -91.12 114.92 27.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.273 172.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -62.35 138.79 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.964 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.18 -40.06 70.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.691 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 p -64.62 -34.85 79.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.144 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -71.58 -33.78 69.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.334 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.65 -53.87 24.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.549 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -46.67 -71.91 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.935 169.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.43 37.44 60.23 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.683 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -80.78 -49.72 10.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.152 0.501 . . . . 0.0 110.061 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.568 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -160.12 106.14 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.419 177.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 61.3 mtm -76.83 -21.15 55.47 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 175.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 32.0 t70 -58.8 -27.63 65.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.092 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.7 pt20 -84.07 -24.74 30.26 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.116 0.484 . . . . 0.0 109.884 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 63.5 m -73.45 -29.89 62.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 55.7 tptt -62.67 -53.42 54.72 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.721 177.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -69.69 -43.77 71.79 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.041 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -69.51 -41.18 76.4 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.293 -174.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.493 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 7.1 mt -82.07 -16.58 49.59 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.613 -177.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.0 m 57.79 43.31 22.06 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.564 HD22 HD11 ' A' ' 47' ' ' LEU . 50.1 mt -57.65 129.71 81.25 Favored Pre-proline 0 N--CA 1.468 0.433 0 CA-C-N 114.669 -1.151 . . . . 0.0 110.262 -175.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.536 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 20.6 Cg_exo -65.88 155.83 67.34 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 121.95 1.767 . . . . 0.0 110.449 173.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.85 -34.82 70.13 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.069 0.462 . . . . 0.0 111.032 -176.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 m -70.18 -42.1 72.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.235 -176.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.539 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.4 t -72.62 -53.85 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.63 -173.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.683 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.9 p -59.64 -30.64 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.177 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.87 -52.46 56.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.75 175.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.25 -38.1 68.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -176.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.683 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 2.4 pp -61.43 -32.56 72.53 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.742 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -64.67 8.18 0.13 Allowed 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 174.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -67.05 111.99 4.15 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.272 1.396 . . . . 0.0 111.011 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.31 -4.36 58.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.05 0.452 . . . . 0.0 110.56 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -90.03 145.29 25.19 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -83.31 58.53 4.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.437 0.637 . . . . 0.0 110.636 -178.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.527 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 5.5 t70 -42.6 -40.68 2.78 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.527 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 40.9 m-20 78.62 25.41 0.54 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.783 0.72 . . . . 0.0 111.155 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.43 175.82 9.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 0.0 110.957 178.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.32 124.56 52.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.487 ' HE3' HD11 ' A' ' 52' ' ' ILE . 45.9 ttm -78.84 92.74 4.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.049 0.452 . . . . 0.0 110.484 -178.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 -30.91 13.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.71 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.39 135.14 48.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 122.005 0.907 . . . . 0.0 110.827 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.84 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 1.5 mpt_? -73.69 -30.94 63.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.845 -1.525 . . . . 0.0 109.919 -170.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.564 HD11 HD22 ' A' ' 25' ' ' LEU . 4.1 mm? -73.64 -15.63 61.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.032 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.88 -59.22 2.49 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.931 ' HA3' HD12 ' A' ' 112' ' ' ILE . . . -38.82 -47.07 2.35 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 115.361 -0.836 . . . . 0.0 114.057 166.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -66.5 -41.07 89.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.452 1.126 . . . . 0.0 111.752 177.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.9 -18.06 65.2 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -177.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.487 HD11 ' HE3' ' A' ' 43' ' ' MET . 46.2 mm -56.78 -37.34 52.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.921 0.391 . . . . 0.0 110.671 176.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.403 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 60.3 t30 -141.08 86.59 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 0.0 110.307 178.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.7 p -106.82 -46.85 3.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.473 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -68.2 -44.98 74.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.086 -174.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.467 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.26 -13.32 58.61 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.9 0.381 . . . . 0.0 110.246 -174.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.658 ' HA ' HG12 ' A' ' 61' ' ' VAL . 91.3 m -79.05 -34.56 43.68 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.297 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -75.93 -20.93 57.58 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.433 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.467 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.5 mt -65.42 -66.19 0.58 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.482 175.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -177.19 116.59 0.1 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.658 HG12 ' HA ' ' A' ' 57' ' ' THR . 7.0 p -173.31 32.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 121.313 0.578 . . . . 0.0 111.52 -174.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.623 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 23.4 m -109.55 115.88 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 121.161 -0.962 . . . . 0.0 111.992 -175.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -74.51 -54.5 3.04 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.766 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.623 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 18.7 Cg_endo -99.15 -141.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 123.134 2.556 . . . . 0.0 113.246 -172.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -75.45 10.1 1.84 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.668 -175.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.38 -75.32 0.42 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.206 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.638 HD21 HD23 ' A' ' 68' ' ' LEU . 2.2 p-10 -70.35 152.86 43.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.962 -0.619 . . . . 0.0 110.8 177.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.638 HD23 HD21 ' A' ' 67' ' ' ASN . 3.9 mm? 69.13 34.81 2.92 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.574 0.546 . . . . 0.0 112.106 173.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.623 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 6.4 p-80 -73.31 77.53 1.34 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.738 0.78 . . . . 0.0 110.514 174.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -86.41 -61.71 1.68 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.746 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.94 56.21 Favored Glycine 0 CA--C 1.51 -0.275 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.444 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -58.71 -28.53 65.9 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.181 . . . . 0.0 111.44 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.56 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.23 -37.15 66.49 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.697 -0.627 . . . . 0.0 110.885 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.9 mmmt -81.03 -31.42 34.57 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.111 178.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.638 ' HA ' ' HE3' ' A' ' 78' ' ' MET . 27.2 t70 -64.73 -40.31 95.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.327 173.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -62.98 -32.35 73.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 176.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.89 -38.62 79.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.69 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.638 ' HE3' ' HA ' ' A' ' 75' ' ' ASP . 66.0 mtm -69.26 -27.69 65.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.315 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.915 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -91.42 -12.44 34.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.46 179.266 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -141.33 90.98 2.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 O-C-N 122.183 -0.323 . . . . 0.0 111.042 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 109.55 -62.49 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.432 -0.89 . . . . 0.0 113.524 173.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.564 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.38 124.36 34.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.634 0.254 . . . . 0.0 110.912 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.648 ' OD2' HG21 ' A' ' 85' ' ' THR . 4.6 p-10 -83.75 171.34 13.27 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.551 174.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -48.54 72.61 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.393 -164.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.767 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.0 t -61.0 -36.74 80.28 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.054 -173.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.451 ' HE2' ' OD1' ' A' ' 83' ' ' ASP . 50.4 mtm -81.01 -38.96 26.64 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.409 0.623 . . . . 0.0 109.5 -173.101 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.55 -39.64 84.65 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.165 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -72.32 -25.92 61.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.368 -177.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.767 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.1 mm-40 -77.99 -25.58 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.522 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 tp -88.13 -46.36 9.35 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.494 -176.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.441 ' HA ' HD12 ' A' ' 94' ' ' ILE . 15.4 m -56.92 -36.61 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.108 -173.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -65.73 -42.37 91.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.901 0.381 . . . . 0.0 110.579 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.6 mp -61.85 -38.88 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.041 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.522 HG13 ' O ' ' A' ' 90' ' ' LEU . 47.1 mt -59.91 -45.79 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.209 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -68.51 -34.45 75.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.29 -49.68 5.13 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.47 -0.872 . . . . 0.0 112.244 -173.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 7.7 m -73.33 -31.23 63.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.563 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.649 ' HG3' ' CG1' ' A' ' 114' ' ' VAL . 18.8 mt-10 -65.29 -34.43 78.32 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.401 1.001 . . . . 0.0 110.271 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -64.81 -44.03 91.22 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.171 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.6 m -101.49 9.11 41.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -174.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -67.66 150.34 97.87 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.413 ' C ' ' H ' ' A' ' 104' ' ' ASN . 37.5 Cg_exo -57.5 159.75 15.72 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 0.0 111.358 177.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.48 23.88 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.535 2.157 . . . . 0.0 113.078 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.413 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.8 m-20 -94.71 91.92 6.75 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.48 95.98 7.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.558 0.694 . . . . 0.0 110.427 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.4 t70 -101.26 133.69 45.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.791 177.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -29.39 -72.32 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 O-C-N 125.327 1.642 . . . . 0.0 112.947 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.0 t -96.41 -21.79 17.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.84 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 59.1 ttp -77.39 -15.75 59.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.883 -0.51 . . . . 0.0 112.237 -168.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.486 ' CG ' ' H ' ' A' ' 111' ' ' THR . 12.1 ptmm? -56.27 -51.76 66.99 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 122.431 1.11 . . . . 0.0 109.355 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.486 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -60.18 -13.0 10.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.446 173.011 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.931 HD12 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -89.02 -40.58 13.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.29 -37.26 84.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.652 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.649 ' CG1' ' HG3' ' A' ' 98' ' ' GLU . 12.1 m -77.61 -35.67 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.885 178.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.451 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -62.14 -49.27 76.55 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.17 0.51 . . . . 0.0 111.204 179.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.527 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 21.6 ptt? -69.79 -17.91 63.44 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.478 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.931 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 39.5 t -69.46 -32.78 71.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 122.143 0.973 . . . . 0.0 109.022 176.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -74.11 -38.11 63.93 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.93 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.577 ' HD2' ' C ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -67.66 -26.37 66.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 118.364 -1.334 . . . . 0.0 111.629 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.931 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -64.72 -56.36 14.19 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.539 -1.265 . . . . 0.0 109.354 172.05 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.0 -41.65 88.17 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.944 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.433 HD11 HG21 ' A' ' 122' ' ' ILE . 0.4 OUTLIER -59.26 -35.18 56.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.305 0.502 . . . . 0.0 110.697 176.296 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -72.06 -30.52 65.23 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 176.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -72.5 -33.71 67.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.121 0.486 . . . . 0.0 110.146 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.56 -35.49 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.412 171.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 69.29 -86.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.464 0.706 . . . . 0.0 112.391 176.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -76.5 124.25 27.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.201 0.524 . . . . 0.0 112.171 -173.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.2 m -124.12 155.22 68.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.526 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 130' ' ' ASN . 16.9 Cg_exo -68.18 93.01 0.4 Allowed 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.702 2.268 . . . . 0.0 113.069 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.446 ' HB3' ' O ' ' A' ' 129' ' ' PRO . 2.8 p-10 176.23 165.69 0.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.055 171.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.6 mmt -129.58 137.11 50.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.703 0.287 . . . . 0.0 110.658 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -87.34 95.45 10.0 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.971 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.487 ' H ' ' CD1' ' A' ' 133' ' ' LEU . 0.0 OUTLIER -99.67 8.74 44.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.402 -177.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 30.4 t -94.58 86.68 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.043 0.449 . . . . 0.0 110.305 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.84 111.85 35.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -165.25 -57.91 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.885 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 53.24 84.21 0.06 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.445 0.64 . . . . 0.0 110.526 -178.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.98 115.55 2.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.942 -175.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.2 tp -113.94 105.75 13.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.188 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -107.99 -174.62 2.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.628 -174.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 66.47 28.83 9.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.926 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.25 1.09 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.202 176.581 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.907 0.384 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -90.2 -0.67 5.47 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.924 2.416 . . . . 0.0 112.645 -177.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -50.17 -70.61 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.903 0.752 . . . . 0.0 112.376 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.5 tt -87.2 -10.75 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.61 177.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 51.1 ttp -62.65 -40.76 98.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.469 0.652 . . . . 0.0 109.53 179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -92.18 100.59 13.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.568 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -61.54 124.77 21.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.309 -172.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.12 -30.61 71.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.143 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.495 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 3.4 p -69.31 -35.34 75.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.577 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.4 -26.59 61.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.278 177.275 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.55 -40.01 84.98 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.495 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 33.0 m-85 -55.02 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.341 168.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.64 36.08 17.73 Favored Glycine 0 C--N 1.346 1.085 0 C-N-CA 121.108 -0.568 . . . . 0.0 113.747 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.472 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 2.2 tmmm? -65.88 -39.14 90.4 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.026 0.441 . . . . 0.0 110.58 -177.53 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.01 96.91 2.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.131 0.491 . . . . 0.0 111.498 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -80.14 -32.71 38.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -56.59 -40.49 75.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.307 -1.315 . . . . 0.0 111.693 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -88.12 -24.78 23.29 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.42 -169.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.2 t -73.37 -36.07 66.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 119.949 -0.7 . . . . 0.0 109.138 173.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 1.064 ' HA ' HD12 ' A' ' 25' ' ' LEU . 10.6 tptt -63.44 -39.29 94.09 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.643 0.735 . . . . 0.0 109.877 176.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -69.19 -40.92 77.76 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.651 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -71.46 -44.47 64.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.756 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 10.6 mt -86.35 -4.8 59.24 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.463 -175.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.3 t 63.3 34.26 13.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.509 176.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 1.064 HD12 ' HA ' ' A' ' 20' ' ' LYS . 6.4 mp -50.42 119.24 10.66 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.931 -176.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.49 ' HD3' HD23 ' A' ' 47' ' ' LEU . 13.0 Cg_exo -73.75 162.89 38.55 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.979 2.453 . . . . 0.0 111.655 174.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.596 ' HA ' HG23 ' A' ' 30' ' ' VAL . 6.4 p-10 -62.81 -29.67 70.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -174.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 t -68.18 -37.61 81.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.339 0.59 . . . . 0.0 110.03 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.836 HG22 HD21 ' A' ' 47' ' ' LEU . 41.5 t -75.45 -49.96 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.706 -177.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.596 HG23 ' HA ' ' A' ' 27' ' ' ASP . 16.6 m -55.91 -35.12 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.672 0.272 . . . . 0.0 110.749 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.57 69.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 0.0 111.632 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -68.43 -38.33 81.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.9 0.857 . . . . 0.0 109.17 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 3.1 tm? -55.76 -55.67 29.61 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.996 175.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -67.9 12.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.777 HD22 ' HB2' ' A' ' 39' ' ' ASP . 33.8 t30 -56.19 110.96 0.84 Allowed 'General case' 0 C--N 1.35 0.6 0 CA-C-N 120.051 1.296 . . . . 0.0 110.547 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -78.71 -27.86 45.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.679 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -88.3 157.77 18.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 -174.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.454 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 7.1 mptt -82.83 61.24 5.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.764 -175.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.777 ' HB2' HD22 ' A' ' 35' ' ' ASN . 1.0 OUTLIER -43.79 -48.21 8.12 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.628 176.108 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 68.19 19.68 9.06 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 118.258 0.481 . . . . 0.0 111.016 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -78.42 179.12 7.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.005 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 t -89.66 130.61 38.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.318 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 42.3 ttm -65.29 104.47 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.089 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.0 p -87.25 -40.62 14.36 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -173.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.499 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 6.2 t70 -90.64 117.48 29.33 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-O 122.284 1.04 . . . . 0.0 110.718 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.59 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.02 -38.45 62.38 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 113.161 -1.836 . . . . 0.0 112.242 175.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.836 HD21 HG22 ' A' ' 29' ' ' VAL . 46.5 tp -68.82 -18.18 64.13 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.939 0.399 . . . . 0.0 111.05 -174.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.7 -55.99 5.01 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.72 -45.37 1.48 Allowed Glycine 0 CA--C 1.533 1.159 0 CA-C-N 114.727 -1.124 . . . . 0.0 114.41 165.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 57.5 m -65.54 -43.41 90.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 118.09 0.945 . . . . 0.0 110.319 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.422 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -68.39 -25.45 65.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.776 -176.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.4 mt -77.24 -26.66 15.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 110.33 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.76 44.36 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 -45.18 2.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.5 -170.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.609 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 3.2 mm? -46.46 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.19 -15.49 53.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.811 0.338 . . . . 0.0 110.899 -172.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 1.5 m -78.62 -32.06 47.26 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.746 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.643 ' HZ3' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.52 -23.43 34.61 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.779 174.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 10.6 mt -63.38 -59.95 4.01 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 121.179 -0.209 . . . . 0.0 111.249 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -174.01 122.53 0.31 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -176.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.522 HG23 ' HB3' ' A' ' 72' ' ' ASN . 9.8 p -177.11 33.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 121.59 0.71 . . . . 0.0 111.142 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.63 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 35.5 m -98.3 114.07 34.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 O-C-N 121.25 -0.907 . . . . 0.0 110.579 -176.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -56.75 4.1 Favored Pre-proline 0 CA--C 1.53 0.198 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.237 -176.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.593 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 4.4 Cg_endo -91.81 -144.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.815 2.343 . . . . 0.0 112.715 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.425 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -74.64 10.5 1.34 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.371 -176.393 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.01 -75.55 0.31 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.572 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.593 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.2 p-10 -75.06 168.61 19.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.051 -0.575 . . . . 0.0 111.075 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.583 HD21 HD21 ' A' ' 67' ' ' ASN . 3.6 mm? 70.12 28.62 3.99 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 123.76 0.663 . . . . 0.0 111.952 173.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 7.9 p80 -76.83 65.9 2.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.402 0.62 . . . . 0.0 110.832 172.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -88.9 -49.75 6.61 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.138 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.11 -51.86 54.84 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.502 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.522 ' HB3' HG23 ' A' ' 61' ' ' VAL . 1.6 t-20 -59.24 -35.65 74.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.72 -0.24 . . . . 0.0 111.512 -176.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.86 -37.07 70.28 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.1 0.476 . . . . 0.0 111.068 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.604 ' O ' ' HG3' ' A' ' 78' ' ' MET . 5.2 mmmp? -80.64 -36.14 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.828 -178.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.639 ' HA ' ' HE1' ' A' ' 78' ' ' MET . 26.0 t70 -65.58 -41.04 93.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -60.63 -37.8 82.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.088 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.79 71.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.298 178.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.639 ' HE1' ' HA ' ' A' ' 75' ' ' ASP . 65.1 mtm -74.36 -34.96 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.797 0.332 . . . . 0.0 111.803 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -93.88 -8.42 40.34 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.93 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -141.89 88.53 2.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.72 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.17 -74.79 0.43 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.424 -0.893 . . . . 0.0 112.621 177.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.532 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -107.66 141.13 39.64 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 165.63 23.77 Favored 'General case' 0 CA--C 1.489 -1.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.458 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 11.2 pt-20 -67.49 -21.39 65.51 Favored 'General case' 0 N--CA 1.409 -2.484 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.628 -164.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.71 -28.2 63.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.643 -179.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.647 ' HA ' HE21 ' A' ' 89' ' ' GLN . 38.8 mtt -83.74 -39.76 19.69 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -65.59 -37.74 87.51 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.718 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.458 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -77.71 -27.01 50.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.8 -174.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.647 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.9 pt20 -79.96 -24.19 41.15 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.209 172.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.488 ' O ' HG13 ' A' ' 94' ' ' ILE . 25.6 tp -81.41 -46.15 15.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.13 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.489 HG12 ' O ' ' A' ' 87' ' ' ALA . 17.7 m -57.57 -33.32 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.959 -175.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.77 -45.16 87.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.326 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.468 HG22 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -67.66 -40.0 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 90' ' ' LEU . 74.2 mt -54.43 -50.05 60.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.275 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -71.76 -33.41 68.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.645 -174.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.1 -49.55 5.53 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.684 -174.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.502 ' HB3' ' HA ' ' A' ' 114' ' ' VAL . 0.1 OUTLIER -72.63 -28.59 62.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.796 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.587 ' HB2' HG12 ' A' ' 114' ' ' VAL . 35.9 tt0 -62.33 -38.62 90.15 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.672 0.273 . . . . 0.0 111.405 170.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -67.43 -33.69 75.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.893 0.378 . . . . 0.0 110.481 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.5 m -96.38 8.76 43.2 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.279 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.61 155.59 87.22 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.705 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.445 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 92.2 Cg_exo -45.08 140.59 7.25 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.159 2.573 . . . . 0.0 112.425 176.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.8 Cg_exo -69.59 24.81 0.17 Allowed 'Trans proline' 0 N--CA 1.476 0.469 0 C-N-CA 123.695 2.93 . . . . 0.0 113.703 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 102' ' ' PRO . 89.3 m-20 -109.04 93.95 4.78 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -76.46 95.13 3.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.648 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.7 t70 -121.2 124.42 44.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.275 172.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.568 ' HD2' ' H ' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -33.81 -51.31 0.39 Allowed 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -178.346 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.568 ' H ' ' HD2' ' A' ' 107' ' ' LYS . 91.4 m -92.4 -30.71 15.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.648 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 62.6 mmm -61.67 -46.08 91.27 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 122.1 0.953 . . . . 0.0 110.162 -176.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.619 ' O ' HG13 ' A' ' 114' ' ' VAL . 15.8 ptmt -66.09 -50.56 63.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.485 -178.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.532 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -58.66 -15.33 11.28 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.27 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.536 HD11 ' O ' ' A' ' 108' ' ' CYS . 1.5 mp -89.16 -39.67 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -38.97 87.44 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.188 174.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.619 HG13 ' O ' ' A' ' 110' ' ' LYS . 2.8 m -80.13 -39.33 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 121.497 0.665 . . . . 0.0 110.11 -173.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.78 -41.39 99.23 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.03 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.642 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -67.33 -24.52 65.74 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.49 -177.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 86.6 m -66.63 -30.74 71.08 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.183 0.516 . . . . 0.0 109.943 174.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.468 ' HB2' HG22 ' A' ' 93' ' ' ILE . 88.9 t80 -70.07 -40.64 74.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.246 177.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.635 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.5 OUTLIER -68.49 -20.4 64.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.898 177.366 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.642 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.84 -49.26 71.29 Favored 'General case' 0 C--N 1.342 0.28 0 O-C-N 121.815 -0.553 . . . . 0.0 109.559 168.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 10.1 mm-40 -58.7 -50.84 72.38 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.165 176.139 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.635 HG23 ' HA ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -54.12 -36.12 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 117.629 0.195 . . . . 0.0 111.24 178.725 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.616 ' N ' HG22 ' A' ' 122' ' ' ILE . 3.9 m170 -70.55 -32.65 70.16 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -68.87 -35.6 77.1 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 110.079 175.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 72.1 mt -68.06 -36.35 79.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.6 174.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.22 -54.55 29.68 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.981 0.512 . . . . 0.0 112.111 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -57.78 107.17 0.43 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.724 -0.217 . . . . 0.0 110.796 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 15.3 m 38.53 83.1 0.21 Allowed Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 124.359 1.037 . . . . 0.0 113.262 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -80.99 156.62 20.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.642 2.228 . . . . 0.0 111.918 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -63.49 130.96 46.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.159 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 22.3 ttt -77.61 108.47 10.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.025 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -150.06 106.99 3.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.84 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -94.62 90.21 6.05 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.331 -176.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.3 p -94.05 93.36 3.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.777 0.799 . . . . 0.0 110.82 178.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.17 104.13 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.785 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -94.02 58.47 2.09 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.426 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -131.84 134.22 45.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.945 0.402 . . . . 0.0 111.225 -174.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -156.2 133.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.293 174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.7 tp -106.04 98.83 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.82 0.343 . . . . 0.0 110.695 -175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.14 105.64 4.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.701 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -123.24 118.92 28.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.544 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 44.4 t . . . . . 0 C--O 1.249 1.06 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.962 -175.33 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.91 ' H1 ' ' HD2' ' A' ' 2' ' ' PRO . 18.3 m . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.91 ' HD2' ' H1 ' ' A' ' 1' ' ' SER . 19.0 Cg_endo -58.21 -14.37 19.4 Favored 'Trans proline' 0 C--N 1.363 1.319 0 C-N-CA 122.783 2.322 . . . . 0.0 113.95 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.402 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.3 mp0 -45.03 -67.56 0.27 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.389 0.43 . . . . 0.0 111.281 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.3 tp -87.68 -11.04 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.84 178.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.758 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.9 mtp -72.9 -21.44 60.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.957 0.408 . . . . 0.0 110.947 -178.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -86.7 81.14 8.32 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 171.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.574 ' ND2' HG13 ' A' ' 52' ' ' ILE . 3.8 m-20 -61.75 130.39 45.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.886 -176.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.426 HD23 HD21 ' A' ' 11' ' ' ASN . 84.7 mt -58.3 -33.78 69.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.51 -178.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.4 t -62.03 -39.41 92.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 109.956 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -76.13 -31.16 58.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.787 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.426 HD21 HD23 ' A' ' 8' ' ' LEU . 87.0 m-20 -67.92 -49.55 61.23 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -48.26 -74.2 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.942 170.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 52.66 35.59 46.32 Favored Glycine 0 C--N 1.344 0.981 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.477 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -73.95 -37.51 64.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 121.053 0.454 . . . . 0.0 110.319 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.424 ' H ' HD12 ' A' ' 55' ' ' LEU . . . -144.52 104.36 4.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.525 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 53.2 ttm -81.16 -32.29 33.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.241 0.544 . . . . 0.0 109.569 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.8 -33.0 68.1 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.7 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -88.1 -25.01 23.23 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.076 -0.65 . . . . 0.0 111.362 -173.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.45 -34.95 70.71 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -63.68 -48.1 78.55 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.374 0.607 . . . . 0.0 110.205 176.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.4 -47.6 60.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.465 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.444 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 2.8 tp10 -69.51 -35.14 75.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.451 0.167 . . . . 0.0 111.349 -173.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.663 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 3.9 mm? -77.31 -22.19 52.32 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 120.939 0.4 . . . . 0.0 110.423 176.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.1 m 58.55 41.52 22.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.53 -169.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.663 ' HG ' ' CB ' ' A' ' 23' ' ' LEU . 55.9 mt -65.68 139.43 97.03 Favored Pre-proline 0 CA--C 1.516 -0.342 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.861 -172.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.584 ' HG2' HG23 ' A' ' 29' ' ' VAL . 75.1 Cg_endo -82.24 163.64 17.37 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.734 2.289 . . . . 0.0 110.259 170.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.82 -33.44 75.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.757 0.313 . . . . 0.0 111.17 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.2 p -67.89 -47.36 69.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 -178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.584 HG23 ' HG2' ' A' ' 26' ' ' PRO . 65.1 t -73.43 -46.94 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.377 -173.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.51 -32.2 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 118.743 0.701 . . . . 0.0 110.634 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.44 -52.01 37.45 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.806 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -66.84 -33.92 76.67 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.6 tp -49.43 -53.98 19.95 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.931 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -65.58 11.89 0.06 Allowed 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.75 98.91 0.21 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.813 1.642 . . . . 0.0 109.789 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -73.5 -20.83 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.129 -174.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -76.76 147.41 37.31 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.408 ' HB3' ' HE3' ' A' ' 5' ' ' MET . 16.7 ptpt -76.08 67.52 2.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.863 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.648 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 3.1 t70 -43.44 -52.23 6.14 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.601 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.71 ' HB3' ' H ' ' A' ' 131' ' ' MET . 26.9 t70 73.19 20.41 3.34 Favored 'General case' 0 C--N 1.355 0.842 0 CA-C-O 122.243 1.021 . . . . 0.0 109.583 -177.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.648 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -85.17 177.97 7.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.359 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.8 t -89.84 126.69 42.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.942 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.8 ttm -71.66 103.43 3.04 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.28 -40.95 17.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.18 -172.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.477 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.0 t70 -89.06 116.63 27.47 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.771 0.796 . . . . 0.0 110.316 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.651 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -54.12 -37.13 64.01 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.901 -1.499 . . . . 0.0 112.257 176.239 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.581 HD23 ' HD3' ' A' ' 26' ' ' PRO . 27.9 tp -66.54 -15.25 63.26 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.286 0.565 . . . . 0.0 110.813 -174.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.31 -51.6 8.7 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.805 ' HA3' HD13 ' A' ' 112' ' ' ILE . . . -40.34 -45.76 3.34 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.004 -0.998 . . . . 0.0 114.366 165.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.503 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 4.0 m -62.0 -46.35 89.61 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.621 1.21 . . . . 0.0 110.061 177.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -80.28 1.74 27.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.006 -175.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.574 HG13 ' ND2' ' A' ' 7' ' ' ASN . 1.9 tp -62.54 -26.91 41.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 173.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -147.32 86.07 1.61 Allowed 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.394 174.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.75 -45.28 5.28 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.524 -177.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.513 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 mt -70.24 -44.48 68.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 0.0 111.49 -173.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.67 -13.2 59.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 -175.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.696 ' HA ' HG11 ' A' ' 61' ' ' VAL . 98.9 m -83.09 -36.75 24.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.164 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 25.0 mtpp -71.52 -21.43 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.56 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 53.4 mt -65.35 -65.67 0.64 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.373 175.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -175.45 113.11 0.13 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.314 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.696 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.0 p -175.38 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.594 0.712 . . . . 0.0 111.408 -177.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.682 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.4 m -103.66 120.9 54.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 120.888 -1.132 . . . . 0.0 111.088 -177.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.33 -56.18 5.51 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.74 177.018 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.0 Cg_endo -97.06 -139.21 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.228 2.619 . . . . 0.0 112.761 -171.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.473 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 65.0 m-20 -75.67 11.94 1.19 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.404 -173.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.32 -71.6 0.5 Allowed Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -174.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.619 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p-10 -77.51 156.03 31.26 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.824 -0.688 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.75 41.39 1.21 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.382 0.611 . . . . 0.0 111.833 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.682 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 5.5 p80 -78.25 80.11 4.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.15 177.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -86.88 -62.59 1.47 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.055 -178.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.07 -54.75 35.43 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.685 -177.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -56.08 -34.66 66.18 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.626 0.251 . . . . 0.0 111.347 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.524 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -66.91 -35.78 80.78 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.246 0.545 . . . . 0.0 111.006 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.562 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.5 mmmt -79.79 -40.01 29.58 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.316 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.59 -39.73 94.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.812 0.339 . . . . 0.0 110.276 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -57.88 -40.85 81.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.541 175.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.04 78.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.716 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.562 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 56.2 mtt -69.93 -39.45 76.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.001 0.429 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -89.08 -9.34 51.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.96 0.409 . . . . 0.0 110.556 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -143.69 91.24 2.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.411 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 118.3 -76.43 0.29 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.565 175.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.418 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -85.04 137.02 33.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.653 0.264 . . . . 0.0 110.697 -176.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -79.2 154.96 28.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 121.369 0.604 . . . . 0.0 109.762 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -63.39 -43.83 96.46 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.985 -167.162 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 2.8 m -51.57 -45.68 63.19 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.863 174.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.433 ' HE2' ' HB2' ' A' ' 86' ' ' MET . 2.7 ptm -76.32 -39.33 54.35 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.413 0.625 . . . . 0.0 109.419 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.538 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -61.03 -36.38 79.38 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.02 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.744 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.7 mp0 -70.8 -25.27 62.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.976 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.4 mm-40 -78.08 -24.46 47.63 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.518 ' O ' HG13 ' A' ' 94' ' ' ILE . 23.4 tp -87.23 -46.16 9.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.683 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.744 HG22 ' HA ' ' A' ' 88' ' ' GLN . 5.2 m -60.89 -28.51 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -44.17 93.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.63 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.8 mp -67.52 -41.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.118 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 90' ' ' LEU . 54.5 mt -57.5 -46.95 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.247 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -70.14 -33.85 72.32 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.418 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -54.93 3.23 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.151 -1.023 . . . . 0.0 112.263 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.0 m -72.97 -31.39 64.5 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.496 ' N ' HG13 ' A' ' 114' ' ' VAL . 42.3 tt0 -68.13 -36.39 79.63 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.456 1.025 . . . . 0.0 110.789 171.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -64.27 -43.21 95.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.918 0.39 . . . . 0.0 110.858 177.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 m -104.1 25.53 9.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.25 155.42 92.36 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.297 178.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.464 ' C ' ' H ' ' A' ' 104' ' ' ASN . 50.8 Cg_exo -53.7 155.23 14.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.594 2.196 . . . . 0.0 111.699 176.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 15.1 Cg_exo -70.22 24.64 0.19 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.232 2.621 . . . . 0.0 113.191 -177.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.464 ' H ' ' C ' ' A' ' 102' ' ' PRO . 85.2 m-20 -105.4 93.37 4.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -79.5 95.43 5.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.811 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.3 t0 -105.56 120.39 41.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.077 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -29.03 -73.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 O-C-N 125.312 1.633 . . . . 0.0 113.689 -176.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.489 ' O ' HG22 ' A' ' 111' ' ' THR . 18.0 t -97.68 -7.26 31.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.811 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.4 ttt -82.56 -28.2 31.1 Favored 'General case' 0 C--O 1.251 1.134 0 O-C-N 121.417 -0.802 . . . . 0.0 113.005 -168.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.661 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.2 OUTLIER -56.94 -45.15 82.96 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.929 0.871 . . . . 0.0 110.736 -173.125 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.661 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.6 t -58.87 -10.59 2.53 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 0.0 113.126 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.805 HD13 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -91.5 -39.56 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.635 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 9.7 m-20 -58.23 -38.87 77.7 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.222 174.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.631 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 6.3 m -84.88 -31.38 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 CA-C-O 121.416 0.627 . . . . 0.0 110.041 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -61.12 -46.35 90.93 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.246 173.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.635 ' HE3' ' HA ' ' A' ' 113' ' ' ASP . 19.3 ptt? -67.95 -20.45 65.06 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.111 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.871 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 21.4 t -68.69 -30.26 68.89 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.482 0.658 . . . . 0.0 109.263 174.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.63 ' HA ' HG12 ' A' ' 93' ' ' ILE . 71.6 t80 -77.16 -49.37 15.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.298 -178.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.5 ' HE3' ' C ' ' A' ' 119' ' ' LYS 0.254 0.0 OUTLIER -70.96 -16.55 62.66 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.072 177.757 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.871 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -62.26 -54.38 41.61 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.303 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -58.72 -48.96 79.36 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.343 174.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -33.99 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 122.002 -0.436 . . . . 0.0 111.326 178.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -71.98 -31.61 66.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.96 -0.463 . . . . 0.0 111.767 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -66.6 -37.44 84.9 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.924 0.392 . . . . 0.0 110.527 175.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.94 -36.47 82.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.848 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.9 t30 72.46 120.09 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.337 1.065 . . . . 0.0 112.082 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 19.8 p-90 -135.19 22.4 3.48 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.61 177.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 58.4 t 71.28 90.23 0.08 OUTLIER Pre-proline 0 C--O 1.234 0.249 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.821 -170.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.54 162.08 43.76 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 123.171 2.581 . . . . 0.0 111.86 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -117.44 -74.24 0.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.857 -176.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' MET . . . . . 0.71 ' H ' ' HB3' ' A' ' 40' ' ' ASP . 23.6 ptt? 35.55 75.33 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.273 0.983 . . . . 0.0 112.157 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -80.52 105.68 11.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.739 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.5 tp -74.45 104.81 5.31 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.358 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 34.6 m -84.35 2.1 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.032 178.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm 73.42 124.6 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.8 -149.91 3.34 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.684 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -155.47 129.74 8.9 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.369 -0.489 . . . . 0.0 111.143 179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 95.4 t -87.39 135.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.461 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.643 HD22 ' H ' ' A' ' 139' ' ' LEU . 2.1 pt? -111.88 113.44 25.77 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 174.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -121.12 158.1 28.66 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.787 -175.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -141.41 165.4 27.62 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.707 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.245 0.846 0 CA-C-O 119.014 -0.517 . . . . 0.0 110.601 178.956 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.428 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 26.1 p . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 110.456 -0.201 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.559 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 13.0 Cg_endo -57.96 -21.48 49.93 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.858 2.372 . . . . 0.0 112.8 179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.428 ' OE1' ' HB2' ' A' ' 1' ' ' SER . 2.3 mp0 -54.04 -69.7 0.12 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.127 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.581 ' HB ' ' HE2' ' A' ' 86' ' ' MET . 10.6 tp -73.91 -13.43 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 110.926 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.559 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.3 ttt -72.39 -29.97 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.059 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -81.52 96.84 7.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.44 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.401 HD22 HG21 ' A' ' 52' ' ' ILE . 25.8 t-20 -66.55 128.46 36.3 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.494 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 22.2 mt -54.94 -45.64 74.88 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -176.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -66.12 -35.51 80.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.453 0.168 . . . . 0.0 110.914 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -70.45 -36.68 74.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.136 0.493 . . . . 0.0 110.482 177.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -67.3 -55.36 14.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.907 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 31.2 m-85 -50.41 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.49 -0.777 . . . . 0.0 113.036 173.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.06 35.69 54.78 Favored Glycine 0 C--N 1.342 0.911 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.188 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.445 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 9.0 tmtt? -85.44 -36.81 20.39 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.985 0.422 . . . . 0.0 110.155 -176.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.55 88.38 2.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.28 0.562 . . . . 0.0 110.873 -176.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.6 mtm -82.53 -45.62 14.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.051 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -60.24 -44.61 95.1 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.119 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.443 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 3.7 mm100 -87.23 -21.05 26.08 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.279 -171.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -75.72 -31.9 59.83 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 170.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.661 ' HE2' HG13 ' A' ' 30' ' ' VAL . 27.5 tptp -57.8 -55.39 35.51 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.49 178.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -73.85 -39.57 63.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.09 -177.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.522 ' CD ' ' HZ1' ' A' ' 58' ' ' LYS . 19.1 tt0 -70.35 -32.73 70.56 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -172.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.5 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -83.8 -1.16 53.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.019 0.438 . . . . 0.0 110.08 178.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t 63.81 29.06 14.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.901 -177.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.565 HD13 ' HA ' ' A' ' 20' ' ' LYS . 21.3 mt -70.62 128.34 91.11 Favored Pre-proline 0 N--CA 1.45 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.521 -172.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.753 ' HD3' HD23 ' A' ' 47' ' ' LEU . 57.6 Cg_endo -79.76 151.92 22.11 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 121.798 1.666 . . . . 0.0 108.847 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -31.83 66.31 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.871 -176.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 p -65.06 -52.81 53.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.653 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.521 HG23 ' HG2' ' A' ' 26' ' ' PRO . 90.0 t -69.5 -50.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -175.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.661 HG13 ' HE2' ' A' ' 20' ' ' LYS . 9.6 p -61.18 -32.75 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.827 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.05 -46.67 50.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.953 0.406 . . . . 0.0 111.12 177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.28 -38.25 88.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.182 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.724 HD11 ' HB2' ' A' ' 48' ' ' ALA . 23.4 tp -55.7 -56.86 15.47 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.855 171.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -68.59 11.64 0.17 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -52.12 125.44 15.68 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 120.24 1.382 . . . . 0.0 110.223 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -70.21 -33.68 71.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.631 -175.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -90.5 142.91 27.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.561 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -75.8 78.21 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.42 0.629 . . . . 0.0 110.918 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -42.83 -46.72 5.36 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.759 173.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 70.42 32.25 2.78 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.835 0.826 . . . . 0.0 110.112 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.28 175.69 9.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.836 175.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.0 t -90.95 127.3 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 169.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.67 ' HE1' HD12 ' A' ' 52' ' ' ILE . 49.9 ttm -69.31 94.38 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.181 0.515 . . . . 0.0 109.797 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 p -85.01 -36.26 21.4 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.141 -174.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.535 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.8 t70 -87.04 117.0 25.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.754 0.788 . . . . 0.0 110.597 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.621 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.39 -37.5 62.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.354 175.612 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.753 HD23 ' HD3' ' A' ' 26' ' ' PRO . 33.4 tp -68.92 -14.87 63.3 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.234 0.54 . . . . 0.0 111.013 -172.568 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.724 ' HB2' HD11 ' A' ' 33' ' ' LEU . . . -76.74 -54.83 6.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.94 -47.17 1.85 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.505 166.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 5.9 m -63.16 -45.02 93.83 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.242 1.021 . . . . 0.0 110.645 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.528 ' HB1' HD21 ' A' ' 25' ' ' LEU . . . -72.34 -11.41 60.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.276 -176.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.67 HD12 ' HE1' ' A' ' 43' ' ' MET . 67.6 mt -58.67 -39.03 74.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 109.846 173.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.58 84.81 2.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.597 0.713 . . . . 0.0 110.425 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -116.32 -48.26 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.751 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.32 -48.29 23.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 111.484 -172.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB2' ' HZ ' ' A' ' 76' ' ' PHE . . . -81.01 -15.61 55.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.366 0.603 . . . . 0.0 109.958 -174.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.806 HG21 HG12 ' A' ' 61' ' ' VAL . 55.4 m -80.71 -35.89 32.91 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.267 174.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.522 ' HZ1' ' CD ' ' A' ' 22' ' ' GLU . 50.2 mtpt -71.8 -22.46 61.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 176.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -63.67 -64.04 1.01 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.059 175.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -175.24 119.86 0.19 Allowed 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.806 HG12 HG21 ' A' ' 57' ' ' THR . 10.4 p -171.11 32.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.645 0.736 . . . . 0.0 111.096 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.612 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 1.3 m -108.12 122.08 62.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.037 -1.04 . . . . 0.0 111.2 -175.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -53.58 2.77 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.013 177.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.641 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 22.7 Cg_endo -99.72 -139.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.08 2.52 . . . . 0.0 113.326 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.47 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.5 t70 -72.9 10.67 0.83 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.477 -173.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.75 -67.84 0.55 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.203 -0.998 . . . . 0.0 111.523 -173.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.692 HD21 HD23 ' A' ' 68' ' ' LEU . 2.8 p-10 -82.37 154.93 24.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.95 -0.625 . . . . 0.0 111.243 -178.247 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.692 HD23 HD21 ' A' ' 67' ' ' ASN . 4.4 mm? 69.32 38.57 1.82 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.228 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.612 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 14.3 p80 -75.78 81.06 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.371 0.605 . . . . 0.0 111.233 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -86.41 -61.67 1.69 Allowed 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.744 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.97 -56.37 25.11 Favored Glycine 0 CA--C 1.508 -0.378 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.79 -175.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -55.49 -29.63 59.14 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 123.712 0.301 . . . . 0.0 111.44 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.557 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.74 -36.51 65.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.36 0.6 . . . . 0.0 111.235 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.576 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.2 mmmt -79.18 -39.8 32.46 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.417 ' O ' ' HD2' ' A' ' 79' ' ' LYS . 21.4 t70 -60.7 -41.02 94.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.976 174.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.584 ' HZ ' ' HB2' ' A' ' 56' ' ' ALA . 54.3 t80 -56.44 -42.78 78.68 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.084 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.37 -25.19 63.15 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.483 -0.487 . . . . 0.0 111.264 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.576 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 48.4 mtt -68.39 -39.48 81.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.357 178.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.417 ' HD2' ' O ' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -93.41 -7.84 43.46 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.466 178.001 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 43.9 m-70 -134.71 89.21 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.711 176.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 123.32 -68.65 0.47 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.329 -0.939 . . . . 0.0 112.9 171.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.1 150.48 20.79 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.032 0.444 . . . . 0.0 111.478 -175.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.726 ' H ' ' HE1' ' A' ' 86' ' ' MET . 5.5 m-20 -76.66 151.22 36.24 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.4 OUTLIER -71.11 -32.69 69.34 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.151 -168.06 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.26 -28.63 65.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.848 174.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.726 ' HE1' ' H ' ' A' ' 83' ' ' ASP . 20.1 mtm -88.24 -41.59 12.84 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.543 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -58.82 -39.24 80.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.442 171.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -74.85 -27.16 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 122.642 0.377 . . . . 0.0 111.776 -175.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.502 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.0 pt20 -80.99 -22.81 39.18 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.589 172.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.495 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -83.42 -42.19 17.25 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.911 -179.149 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 87' ' ' ALA . 18.6 m -57.59 -32.47 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -45.12 95.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.158 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.69 HG23 ' SG ' ' A' ' 117' ' ' CYS . 3.3 mm -65.84 -44.16 92.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.53 174.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.5 mt -52.72 -47.8 50.04 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.771 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -70.19 -34.75 73.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.424 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.52 -52.36 3.98 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.59 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.6 m -72.29 -32.19 66.39 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.924 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.466 ' HB2' HG13 ' A' ' 114' ' ' VAL . 34.0 tt0 -67.86 -38.41 83.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.959 0.8 . . . . 0.0 110.411 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.62 -43.54 89.24 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.941 0.4 . . . . 0.0 110.49 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -96.01 16.99 16.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.046 -176.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.39 151.42 91.93 Favored Pre-proline 0 C--N 1.325 -0.48 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 104' ' ' ASN . 52.5 Cg_exo -53.51 156.64 10.85 Favored 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 122.779 2.319 . . . . 0.0 112.156 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.07 24.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.062 2.508 . . . . 0.0 113.265 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . 0.49 ' H ' ' C ' ' A' ' 102' ' ' PRO . 67.5 m-20 -90.17 93.91 9.55 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -80.94 96.55 7.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.05 -177.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.9 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 11.9 t70 -122.32 105.87 10.58 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -29.26 -58.49 0.15 Allowed 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.954 1.409 . . . . 0.0 114.116 -177.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.8 t -93.98 -12.69 28.16 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.89 -0.506 . . . . 0.0 112.246 -173.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.9 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.3 ttt -85.7 -27.62 25.19 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.777 0.799 . . . . 0.0 111.617 -169.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -39.15 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.257 -177.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -16.82 9.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.685 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.578 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.8 mp -87.73 -36.0 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.767 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 14.5 t70 -58.86 -36.2 74.22 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.781 177.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.466 HG13 ' HB2' ' A' ' 98' ' ' GLU . 8.5 m -80.21 -38.35 18.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 O-C-N 121.919 -0.488 . . . . 0.0 110.758 177.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.89 -46.92 88.71 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.864 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.767 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -73.18 -21.02 60.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.775 178.219 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.69 ' SG ' HG23 ' A' ' 93' ' ' ILE . 11.2 t -66.92 -28.68 68.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 0.0 109.804 171.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -81.04 -48.16 12.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.916 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.751 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.1 -29.25 66.17 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 118.473 -1.291 . . . . 0.0 110.404 -179.873 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' A' ' 116' ' ' MET . 11.0 ttmt -55.4 -54.85 38.63 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.24 170.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 19.9 mm-40 -57.76 -51.59 68.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.609 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.426 HG22 ' N ' ' A' ' 123' ' ' HIS . 1.8 tt -59.33 -33.16 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 118.034 0.379 . . . . 0.0 111.53 -179.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.426 ' N ' HG22 ' A' ' 122' ' ' ILE . 3.4 m-70 -71.96 -30.72 65.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.314 175.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -74.13 -35.84 64.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.072 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.6 8.33 25.71 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 0.437 ' N ' HD21 ' A' ' 126' ' ' ASN . 0.9 OUTLIER 64.47 168.34 0.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.355 0.598 . . . . 0.0 111.542 -176.771 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 3.1 p90 -109.87 -177.16 3.19 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.435 -173.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.526 ' HB ' ' HD2' ' A' ' 129' ' ' PRO . 26.8 m -78.39 172.51 9.67 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.092 177.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.526 ' HD2' ' HB ' ' A' ' 128' ' ' VAL . 70.3 Cg_exo -54.43 94.34 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.383 2.056 . . . . 0.0 113.203 174.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -168.95 -171.14 1.27 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 174.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 59.0 mtt -118.35 102.05 8.65 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -79.62 111.01 15.49 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.1 mp -100.9 29.59 4.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.391 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.69 13.35 7.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.856 0.836 . . . . 0.0 109.252 178.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -74.69 17.73 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.323 177.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -91.17 41.83 2.88 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 177.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.61 111.85 0.8 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.31 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 5.7 m -70.78 102.53 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.934 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.74 93.91 6.29 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -91.46 97.22 10.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.795 -177.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -95.06 -86.77 0.29 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.546 176.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.9 t . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.337 177.656 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 N--CA 1.48 1.064 0 CA-C-O 120.764 0.316 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.578 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 96.9 Cg_endo -81.17 2.17 8.76 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.975 2.45 . . . . 0.0 113.206 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -50.11 -69.2 0.12 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.622 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.6 tp -73.45 -10.89 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.38 0.609 . . . . 0.0 111.101 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.578 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 77.0 mtp -79.31 -21.71 45.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.552 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.731 ' HZ3' ' HB2' ' A' ' 6' ' ' LYS . 4.7 ttmp? -81.1 80.98 7.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.203 0.525 . . . . 0.0 109.601 177.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -62.12 134.09 56.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.356 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.506 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.0 mp -54.9 -45.86 74.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.807 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -63.9 -32.63 74.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.84 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -74.98 -35.97 62.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.147 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.93 -45.91 69.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.02 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -46.76 -77.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.565 170.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.09 38.66 32.53 Favored Glycine 0 C--N 1.342 0.884 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.173 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -63.81 -55.56 22.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.021 0.439 . . . . 0.0 110.613 -177.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.5 105.37 4.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -70.52 -37.15 74.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.711 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.74 -28.74 69.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.511 -178.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -88.66 -27.18 21.44 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.226 -173.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 t -74.51 -35.02 63.17 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 1.0 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -59.32 -51.28 70.63 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.425 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -73.76 -32.31 63.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.406 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.16 -44.82 75.1 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.633 0.254 . . . . 0.0 110.844 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.601 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 10.5 mt -83.43 -17.29 42.65 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.042 0.449 . . . . 0.0 110.677 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.0 t 66.05 37.97 5.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.587 -177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 1.0 HD22 ' HA ' ' A' ' 20' ' ' LYS . 2.2 mm? -51.04 135.75 28.72 Favored Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.139 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.9 Cg_exo -65.28 149.65 88.25 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.909 1.739 . . . . 0.0 109.504 166.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -60.13 -32.66 71.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.673 0.273 . . . . 0.0 111.017 -174.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 t -70.01 -40.54 75.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.907 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 43.7 t -71.44 -53.14 21.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.392 -176.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.681 HG22 ' HG2' ' A' ' 20' ' ' LYS . 9.9 p -60.34 -36.51 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.804 -178.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.535 ' N ' HG12 ' A' ' 30' ' ' VAL . . . -66.34 -51.52 56.4 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.205 177.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -37.85 88.94 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.229 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.5 tp -54.36 -56.62 16.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.796 173.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -68.97 11.66 0.19 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -59.13 130.55 47.51 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 119.926 1.239 . . . . 0.0 110.12 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -70.34 -35.02 73.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.794 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -84.44 136.98 33.62 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.552 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 3.3 mptp? -85.24 75.21 10.31 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.891 -171.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.486 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 17.4 t70 -44.04 -55.38 4.73 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.291 172.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.9 t70 75.28 35.5 0.57 Allowed 'General case' 0 C--N 1.348 0.529 0 CA-C-O 121.899 0.857 . . . . 0.0 110.386 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.486 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -77.67 178.01 7.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.828 175.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.9 t -84.61 114.8 25.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 174.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.7 ttm -66.71 102.22 0.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.833 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -99.44 -34.8 10.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.104 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.88 117.32 11.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.928 0.87 . . . . 0.0 110.791 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.729 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -47.94 -36.91 13.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.695 -1.593 . . . . 0.0 112.718 174.439 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.703 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.3 mm? -68.5 -20.25 64.57 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.533 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.68 -55.6 4.72 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.27 -43.15 1.4 Allowed Glycine 0 CA--C 1.534 1.232 0 CA-C-N 115.021 -0.99 . . . . 0.0 114.629 167.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.417 ' HB3' HD12 ' A' ' 23' ' ' LEU . 3.2 m -79.61 -43.96 21.89 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.656 1.228 . . . . 0.0 112.174 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.575 ' HB1' HD13 ' A' ' 25' ' ' LEU . . . -71.08 -23.45 62.12 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 tp -73.12 -25.2 21.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.943 0.401 . . . . 0.0 110.305 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.5 43.63 3.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.24 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.578 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 30.7 p -94.55 -44.51 7.82 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.58 -177.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -46.86 88.93 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -171.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.77 -12.27 59.79 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.228 -174.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.561 HG21 ' CG1' ' A' ' 61' ' ' VAL . 89.4 m -83.75 -33.83 24.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.482 174.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 18.6 mmmt -75.08 -23.93 58.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.636 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.96 -65.14 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.054 174.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -177.41 116.68 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 -178.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.561 ' CG1' HG21 ' A' ' 57' ' ' THR . 12.7 p -167.3 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 122.133 0.968 . . . . 0.0 110.113 -177.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.646 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.3 m -107.59 116.89 52.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.419 -177.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -55.08 5.39 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.301 177.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.613 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 1.2 Cg_endo -91.17 -147.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.078 2.519 . . . . 0.0 112.605 -175.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -74.35 2.76 8.61 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -173.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 148.19 -61.35 0.44 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.303 -177.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.613 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 0.3 OUTLIER -87.87 164.17 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.509 -178.475 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.535 ' O ' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER 69.07 28.69 4.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 173.171 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.646 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.0 p80 -80.3 67.87 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.809 -0.557 . . . . 0.0 111.648 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -87.57 -48.43 7.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 110.085 176.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.54 -51.98 54.58 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.153 -176.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.42 -32.7 71.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.716 -0.242 . . . . 0.0 111.3 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.477 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -64.88 -36.07 83.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.629 ' HB3' ' HZ3' ' A' ' 74' ' ' LYS . 4.4 mmmp? -79.74 -36.35 37.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.449 178.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.493 ' HA ' ' HE3' ' A' ' 78' ' ' MET . 15.2 t70 -65.03 -40.96 95.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.345 176.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -63.57 -37.2 86.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.165 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -34.36 73.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.241 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.494 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.8 mtm -74.4 -35.78 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.13 -9.21 46.38 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.52 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.506 ' HB3' HD21 ' A' ' 8' ' ' LEU . 57.1 m-70 -141.07 89.27 2.23 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.687 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.19 -75.12 0.36 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.864 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.96 142.88 28.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.952 0.406 . . . . 0.0 111.63 -174.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.589 ' OD2' HG21 ' A' ' 85' ' ' THR . 2.3 p-10 -77.95 159.54 28.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 170.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.81 -42.31 98.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.132 -162.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.589 HG21 ' OD2' ' A' ' 83' ' ' ASP . 1.6 t -54.13 -27.92 36.45 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.85 177.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.63 ' HA ' ' HG2' ' A' ' 89' ' ' GLN . 75.7 mtp -85.28 -39.58 17.56 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.449 0.642 . . . . 0.0 109.909 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.659 ' O ' HG12 ' A' ' 91' ' ' VAL . . . -65.78 -31.83 73.03 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.947 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.477 ' O ' HG21 ' A' ' 91' ' ' VAL . 2.8 mp0 -82.24 -26.39 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.051 -176.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.63 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 26.1 pt20 -78.22 -22.89 47.81 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.6 tp -75.01 -47.25 30.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.974 175.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.659 HG12 ' O ' ' A' ' 87' ' ' ALA . 32.0 m -57.9 -35.81 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 120.857 0.361 . . . . 0.0 111.44 -176.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -62.69 -43.93 97.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.521 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.565 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.28 -42.71 84.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.19 176.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 55.9 mt -56.01 -48.14 79.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.122 0.487 . . . . 0.0 110.457 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.961 -175.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.56 -44.88 6.31 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.052 -172.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.565 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.9 m -73.09 -41.7 63.79 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 119.321 -0.371 . . . . 0.0 111.35 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -66.38 -29.48 69.66 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.982 173.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -63.71 -39.82 95.25 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.219 0.533 . . . . 0.0 109.951 173.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.7 m -99.58 15.93 24.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.001 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.45 147.73 75.99 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.272 -179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.432 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 70.3 Cg_exo -52.79 151.89 18.63 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.257 2.638 . . . . 0.0 112.606 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 13.9 Cg_exo -70.84 47.1 0.69 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.719 2.946 . . . . 0.0 112.907 -179.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -125.57 94.3 4.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.369 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -81.54 96.5 7.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.101 0.476 . . . . 0.0 111.74 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.513 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 11.6 t70 -112.84 113.81 26.06 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 168.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.608 ' HG2' ' H ' ' A' ' 108' ' ' CYS . 0.9 OUTLIER -33.63 -60.55 0.36 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.608 ' H ' ' HG2' ' A' ' 107' ' ' LYS . 5.9 t -91.19 -12.08 36.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.824 0.738 . . . . 0.0 112.16 -175.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.667 ' HG3' ' HB3' ' A' ' 46' ' ' ARG . 2.9 ttp -81.29 -29.96 34.13 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-O 122.025 0.917 . . . . 0.0 111.525 -171.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.31 -39.11 78.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.565 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.515 ' O ' ' HB1' ' A' ' 115' ' ' ALA . 0.3 OUTLIER -55.96 -15.81 3.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.508 -1.224 . . . . 0.0 112.428 174.552 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.522 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -90.69 -38.57 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.702 ' HA ' ' HE1' ' A' ' 116' ' ' MET . 0.3 OUTLIER -58.31 -38.26 76.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.056 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.559 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -80.86 -35.92 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.525 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.515 ' HB1' ' O ' ' A' ' 111' ' ' THR . . . -61.55 -48.31 81.58 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.702 ' HE1' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -73.52 -19.91 60.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.608 0.718 . . . . 0.0 110.48 178.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.685 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 9.0 t -72.74 -26.4 61.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.583 172.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.417 ' HB2' HG22 ' A' ' 93' ' ' ILE . 87.7 t80 -80.3 -44.0 20.32 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.54 -179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.671 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.48 -28.07 65.76 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.834 179.064 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.685 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -61.32 -50.15 74.11 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 171.132 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 124' ' ' LYS . 0.4 OUTLIER -59.18 -47.91 83.56 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 173.005 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.671 HG23 ' HA ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -55.75 -35.7 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 118.18 0.446 . . . . 0.0 111.266 178.176 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.7 ' HD1' ' HA ' ' A' ' 132' ' ' ASP . 9.5 m170 -70.9 -32.0 68.82 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.82 0.343 . . . . 0.0 111.01 177.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 121' ' ' GLU . 68.3 tttt -66.21 -28.29 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.262 176.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.9 mt -71.7 0.48 8.7 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.164 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 72.86 -56.41 0.66 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.758 . . . . 0.0 112.632 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -67.7 87.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.111 0.481 . . . . 0.0 111.913 -176.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.609 HG13 ' HA ' ' A' ' 123' ' ' HIS . 7.7 p -161.49 130.79 3.19 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.778 177.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 8.8 Cg_exo -73.61 44.1 0.87 Allowed 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.502 2.801 . . . . 0.0 113.355 -178.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . 0.435 ' OD1' ' HE1' ' A' ' 123' ' ' HIS . 27.0 t-20 -159.88 135.15 8.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 176.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 25.3 ttt -55.8 135.4 51.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.274 0.559 . . . . 0.0 111.941 -177.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.7 ' HA ' ' HD1' ' A' ' 123' ' ' HIS . 5.5 p-10 -83.35 130.54 35.06 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.53 175.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -160.74 108.65 1.57 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 14.9 p -123.43 147.24 27.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.425 ' N ' HD11 ' A' ' 135' ' ' ILE . 3.7 mp -95.75 108.36 20.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -73.83 89.38 0.66 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.632 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -61.96 138.56 58.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.016 0.436 . . . . 0.0 111.221 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.54 93.91 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.274 174.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.6 tt -76.31 96.54 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 177.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -71.19 136.55 48.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.807 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -123.91 171.99 9.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.64 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.17 179.494 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.806 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 7.0 m . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.806 ' HD3' ' HB2' ' A' ' 1' ' ' SER . 34.6 Cg_exo -59.69 -17.78 44.44 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 122.699 2.266 . . . . 0.0 114.377 -174.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.8 mp0 -45.68 -69.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.485 0.491 . . . . 0.0 111.341 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.518 HD11 ' HB2' ' A' ' 82' ' ' ALA . 7.6 tp -87.26 -9.48 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.709 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 0.732 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 17.4 tmm? -65.48 -36.17 83.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.923 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.62 ' HB3' ' HZ3' ' A' ' 6' ' ' LYS . 8.8 mtpm? -86.51 97.45 10.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.025 0.44 . . . . 0.0 110.212 177.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -67.36 140.68 57.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.141 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mp -58.82 -38.98 79.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.052 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -58.51 -35.84 72.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.969 0.414 . . . . 0.0 110.805 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -75.39 -33.73 61.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.526 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -68.87 -56.59 7.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.318 176.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -52.19 -77.3 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 176.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.55 36.93 59.52 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.564 -170.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -84.97 -40.45 16.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.048 0.452 . . . . 0.0 110.666 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.48 59.43 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.688 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.64 ' HE2' ' HH ' ' A' ' 34' ' ' TYR . 16.1 tpt -70.11 -39.71 75.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.196 0.522 . . . . 0.0 110.263 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -61.2 -30.14 70.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.809 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -88.78 -20.52 24.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.01 -0.676 . . . . 0.0 111.919 -174.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -75.21 -32.55 61.22 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 168.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.941 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 26.2 tptp -61.32 -47.92 83.74 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.443 175.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -72.77 -38.16 67.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.802 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -61.12 -41.71 97.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.895 0.378 . . . . 0.0 110.79 -176.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.551 ' HB3' HD11 ' A' ' 47' ' ' LEU . 12.9 mt -86.6 -10.89 52.95 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.722 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t 57.55 41.68 25.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.55 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.941 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 16.2 mt -51.28 119.82 13.34 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.878 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.649 ' HD3' HD23 ' A' ' 47' ' ' LEU . 13.7 Cg_exo -72.24 157.94 52.77 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.751 2.301 . . . . 0.0 110.815 171.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.537 ' HA ' HG23 ' A' ' 30' ' ' VAL . 7.7 p-10 -65.17 -27.22 68.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -175.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.1 m -68.82 -39.64 79.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.902 0.382 . . . . 0.0 110.516 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.788 HG22 HD21 ' A' ' 47' ' ' LEU . 58.0 t -72.33 -44.52 63.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.537 HG23 ' HA ' ' A' ' 27' ' ' ASP . 11.1 m -59.87 -31.7 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 110.566 175.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.65 -52.12 58.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.948 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -67.34 -36.37 81.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.32 -56.93 13.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.365 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.64 ' HH ' ' HE2' ' A' ' 16' ' ' MET . 41.4 m-85 -69.04 10.56 0.28 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -66.27 103.81 1.07 Allowed 'General case' 0 C--N 1.344 0.344 0 CA-C-N 120.108 1.322 . . . . 0.0 110.178 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -71.0 -32.37 69.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.109 -175.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -90.23 101.9 14.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.586 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.623 ' HB2' ' HZ1' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -72.64 79.69 1.09 Allowed 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.599 0.714 . . . . 0.0 110.443 179.248 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.81 12.89 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.49 -1.232 . . . . 0.0 114.056 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.0 t70 60.02 70.89 0.6 Allowed 'General case' 0 C--N 1.343 0.321 0 CA-C-N 118.695 0.68 . . . . 0.0 110.176 -168.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -115.52 176.35 5.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.762 177.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.7 t -108.89 121.62 62.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.1 ttm -77.68 100.65 6.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.4 p -94.21 -29.92 14.85 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.165 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -78.0 115.06 17.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.677 0.751 . . . . 0.0 110.13 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.882 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -57.27 -35.2 69.48 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.921 174.527 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.788 HD21 HG22 ' A' ' 29' ' ' VAL . 56.5 tp -64.92 -17.81 64.67 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 120.978 0.418 . . . . 0.0 110.795 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.67 1.8 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.03 -45.66 2.24 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 115.215 -0.902 . . . . 0.0 114.672 166.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 86.7 m -64.33 -42.64 96.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.307 1.053 . . . . 0.0 110.408 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.85 -25.11 67.76 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.646 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.1 mt -73.35 -35.57 46.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.188 0.518 . . . . 0.0 110.164 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -104.75 44.74 1.0 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.431 -175.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t -112.27 -47.95 3.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.94 -52.06 58.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.34 0.59 . . . . 0.0 111.037 -170.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.92 -11.58 59.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.273 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.626 ' HA ' HG12 ' A' ' 61' ' ' VAL . 22.5 m -83.36 -35.25 25.28 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.525 175.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -78.1 -17.35 57.04 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.405 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mt -64.91 -66.96 0.48 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.57 172.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -178.29 121.75 0.1 Allowed 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.626 HG12 ' HA ' ' A' ' 57' ' ' THR . 11.9 p -176.63 34.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.906 0.86 . . . . 0.0 111.082 -175.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.529 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 33.6 m -108.52 115.5 49.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 O-C-N 121.158 -0.964 . . . . 0.0 111.422 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.22 -55.84 2.11 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.009 178.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.568 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 15.9 Cg_endo -97.47 -140.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.984 2.456 . . . . 0.0 113.165 -171.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.434 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 16.4 m-20 -72.89 6.71 2.41 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.48 -174.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.17 -75.35 0.43 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.69 HD21 HD23 ' A' ' 68' ' ' LEU . 3.0 p-10 -69.52 153.76 43.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.939 -0.63 . . . . 0.0 111.039 176.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.69 HD23 HD21 ' A' ' 67' ' ' ASN . 4.2 mm? 69.82 32.87 3.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.587 173.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.529 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.5 p-80 -73.73 76.28 1.56 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.388 0.613 . . . . 0.0 110.71 171.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -86.39 -59.12 2.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.699 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.7 -52.36 53.52 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.216 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -58.13 -34.4 70.21 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.832 -0.184 . . . . 0.0 111.458 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.597 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -67.83 -36.45 80.37 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.3 0.572 . . . . 0.0 111.184 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.565 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.5 mmmt -80.03 -37.66 33.61 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.61 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.28 -40.6 96.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.27 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -61.49 -40.56 95.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.45 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.28 73.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.96 0.41 . . . . 0.0 111.179 -178.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.62 ' HE1' ' HB3' ' A' ' 87' ' ' ALA . 53.0 mtt -74.34 -23.7 59.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.088 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -85.88 -15.49 41.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.732 -176.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -146.89 96.71 2.79 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.076 -176.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.54 -71.47 0.22 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.379 -0.915 . . . . 0.0 112.658 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -85.06 139.99 31.33 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.487 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.534 ' OD2' HG21 ' A' ' 85' ' ' THR . 0.3 OUTLIER -84.04 166.18 17.94 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.361 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.595 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.46 -25.61 63.26 Favored 'General case' 0 N--CA 1.416 -2.168 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.414 -167.564 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.766 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.6 OUTLIER -73.87 -31.11 63.0 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.121 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 9.3 tpp -78.54 -48.0 16.14 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.82 0.819 . . . . 0.0 108.946 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.62 ' HB3' ' HE1' ' A' ' 78' ' ' MET . . . -58.73 -36.7 74.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.409 176.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.738 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.14 -25.66 61.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.91 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.766 ' HG2' ' O ' ' A' ' 85' ' ' THR . 14.2 mm-40 -77.77 -25.3 49.0 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.5 tt -87.89 -43.62 11.66 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.862 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.738 HG22 ' HA ' ' A' ' 88' ' ' GLN . 4.8 m -60.9 -27.89 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -66.47 -41.14 89.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.462 0.649 . . . . 0.0 109.861 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.586 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -66.46 -39.34 83.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 176.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.423 HD12 ' HA ' ' A' ' 91' ' ' VAL . 49.3 mt -57.99 -47.39 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.146 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -69.71 -34.88 74.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.55 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.22 -53.09 3.77 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.058 -1.068 . . . . 0.0 112.515 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.7 m -72.42 -32.18 66.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.521 ' OE2' ' HE2' ' A' ' 110' ' ' LYS . 40.3 tt0 -67.21 -34.72 78.08 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.122 0.874 . . . . 0.0 110.114 173.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -63.67 -41.2 98.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.923 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.1 m -103.06 19.57 19.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.72 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.41 155.7 83.72 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.902 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.456 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 71.9 Cg_exo -48.41 135.84 26.01 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.692 2.261 . . . . 0.0 111.636 174.568 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.2 Cg_exo -70.51 49.32 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 123.686 2.924 . . . . 0.0 113.498 -176.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -125.35 94.37 4.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 173.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.408 ' CG ' ' HZ3' ' A' ' 110' ' ' LYS . 2.5 t70 -81.13 84.96 6.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.087 -171.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.652 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.7 t70 -106.94 133.47 51.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.587 176.136 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -30.05 -75.28 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.712 1.258 . . . . 0.0 113.711 -175.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.882 ' HB2' ' HB2' ' A' ' 46' ' ' ARG . 98.1 m -88.63 -10.29 49.13 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.652 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -69.61 -41.17 76.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 -173.557 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.521 ' HE2' ' OE2' ' A' ' 98' ' ' GLU . 14.3 ptmt -65.19 -51.0 63.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.778 0.799 . . . . 0.0 110.373 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.482 ' HA ' HG21 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -59.56 -14.27 12.49 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.575 174.085 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.466 HD11 ' O ' ' A' ' 108' ' ' CYS . 1.0 OUTLIER -87.59 -36.31 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 177.983 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -63.42 -35.26 79.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.356 176.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.532 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 16.0 m -76.36 -37.08 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.985 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.21 78.5 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.308 0.575 . . . . 0.0 111.367 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.604 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.2 ptt? -69.09 -17.68 63.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.281 178.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.586 ' SG ' HG23 ' A' ' 93' ' ' ILE . 31.8 t -73.54 -30.03 62.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.835 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -77.64 -43.23 32.12 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.585 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.652 ' HA ' HG23 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -70.42 -23.42 62.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.903 176.576 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.604 ' HE3' ' O ' ' A' ' 116' ' ' MET . 1.1 ttmt -62.23 -48.29 80.63 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 121.353 -0.842 . . . . 0.0 110.095 170.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -59.14 -45.0 92.09 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.652 HG23 ' HA ' ' A' ' 119' ' ' LYS . 11.8 tt -58.92 -33.41 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-N 118.799 0.727 . . . . 0.0 110.675 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.566 ' N ' HG22 ' A' ' 122' ' ' ILE . 9.8 m170 -71.1 -31.43 67.79 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.448 174.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -66.39 -35.28 79.93 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.527 0.331 . . . . 0.0 111.552 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.529 HD23 ' HA ' ' A' ' 122' ' ' ILE . 0.6 OUTLIER -85.28 10.66 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -179.067 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 68.86 110.98 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.559 0.695 . . . . 0.0 111.236 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.4 p-90 -112.47 -176.78 2.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.493 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.405 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 16.8 m -119.48 131.43 24.39 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.476 177.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 23.7 Cg_exo -63.93 159.19 43.34 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.001 2.467 . . . . 0.0 112.802 -176.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -105.0 153.0 22.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.05 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.85 -174.13 3.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -71.28 119.27 15.18 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.182 178.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.529 HD13 HG23 ' A' ' 134' ' ' VAL . 0.4 OUTLIER -101.54 76.45 1.67 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.096 -178.659 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.529 HG23 HD13 ' A' ' 133' ' ' LEU . 17.3 m 35.56 75.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 124.176 0.99 . . . . 0.0 113.466 178.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.526 ' CD1' ' H ' ' A' ' 135' ' ' ILE . 0.2 OUTLIER -78.71 102.15 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.844 0.831 . . . . 0.0 110.501 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -73.07 160.81 54.17 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 114.777 -1.101 . . . . 0.0 112.345 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -115.43 114.13 24.65 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.009 0.433 . . . . 0.0 110.152 -177.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 79.7 t -96.17 121.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.762 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.9 tt -88.92 110.24 20.92 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -79.15 106.37 11.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.637 -178.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -125.13 143.11 51.09 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.866 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.208 179.688 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.62 0.248 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -86.56 -1.71 8.33 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.963 2.442 . . . . 0.0 112.402 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -45.17 -68.11 0.23 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.173 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.0 tt -83.14 -9.62 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-O 121.002 0.429 . . . . 0.0 111.433 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.2 mmm -66.64 -26.02 66.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.203 0.525 . . . . 0.0 109.799 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -92.93 102.47 14.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.234 166.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -62.92 130.05 43.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 110.888 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 89.6 mt -65.18 -45.04 86.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.598 -176.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 m -60.5 -40.57 91.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.769 0.319 . . . . 0.0 110.771 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -75.89 -24.25 55.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.083 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.456 ' C ' HD21 ' A' ' 11' ' ' ASN . 0.2 OUTLIER -73.43 -50.79 19.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 175.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 34.9 m-85 -50.24 -77.99 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.353 173.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.44 38.52 62.89 Favored Glycine 0 C--N 1.343 0.954 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.717 -177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -68.12 -36.79 80.29 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 117.295 0.547 . . . . 0.0 110.512 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.29 101.52 3.13 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.629 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 50.9 ttm -70.15 -34.43 73.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.105 0.479 . . . . 0.0 109.805 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.35 -38.73 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.279 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -88.29 -25.99 22.51 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.644 -172.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t -75.53 -35.5 60.71 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -47.94 81.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.883 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.73 -37.31 41.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.832 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.534 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 33.9 tp10 -61.45 -41.47 97.26 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.348 0.118 . . . . 0.0 111.025 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.525 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 mm? -79.05 -22.48 45.3 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.325 172.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.2 m 58.44 50.54 9.23 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -170.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.657 HD23 HG13 ' A' ' 29' ' ' VAL . 25.4 mt -66.56 121.5 77.49 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.969 -171.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.556 ' HD2' ' CG2' ' A' ' 29' ' ' VAL . 11.8 Cg_exo -73.3 154.82 51.5 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.558 2.172 . . . . 0.0 110.841 171.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.621 ' HA ' HG23 ' A' ' 30' ' ' VAL . 6.0 p-10 -63.54 -23.6 67.46 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 m -65.79 -39.05 90.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.423 0.63 . . . . 0.0 109.85 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.657 HG13 HD23 ' A' ' 25' ' ' LEU . 58.9 t -70.57 -51.79 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.483 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.621 HG23 ' HA ' ' A' ' 27' ' ' ASP . 16.9 m -57.68 -30.51 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.167 0.508 . . . . 0.0 110.731 179.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.86 -52.23 57.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.63 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.71 -35.68 65.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.804 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 19.3 tp -50.53 -55.46 15.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.793 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.419 ' HD1' ' O ' ' A' ' 30' ' ' VAL . 20.4 m-85 -77.41 11.45 1.97 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -175.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -58.85 111.39 1.27 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 118.28 0.491 . . . . 0.0 109.873 176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -79.05 -17.33 55.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.513 -171.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -91.03 124.71 35.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.633 0.254 . . . . 0.0 110.897 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -75.96 65.46 2.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.736 179.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.705 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 36.5 t70 -54.89 -19.09 5.84 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.771 1.767 . . . . 0.0 115.771 178.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.9 t70 62.63 70.61 0.55 Allowed 'General case' 0 C--N 1.348 0.517 0 CA-C-N 119.717 1.144 . . . . 0.0 109.59 -169.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.705 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.0 p90 -114.75 165.77 12.46 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.375 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.32 117.31 31.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.5 ttm -75.1 102.05 4.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.364 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -107.43 -16.69 14.31 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -77.98 130.94 37.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.479 . . . . 0.0 110.289 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.864 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 3.4 mpt_? -69.99 -27.07 64.41 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.297 -171.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.636 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.7 mm? -80.42 -15.73 56.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.053 -173.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.411 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.34 -61.12 2.03 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.0 -47.69 1.92 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.073 168.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 m -70.79 -42.5 70.26 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.448 1.124 . . . . 0.0 112.042 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.19 -6.28 38.33 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -177.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 48' ' ' ALA . 45.3 mm -57.02 -30.22 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.142 0.496 . . . . 0.0 110.151 172.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.538 ' N ' HD21 ' A' ' 53' ' ' ASN . 0.0 OUTLIER -145.49 86.14 1.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.162 -179.106 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' CYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.0 p -112.72 -47.93 3.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -177.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.426 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 52.7 tp -64.53 -55.41 20.74 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.076 0.465 . . . . 0.0 112.083 -170.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.29 -13.79 58.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.958 0.408 . . . . 0.0 110.268 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.647 HG21 HG12 ' A' ' 61' ' ' VAL . 30.5 m -74.54 -34.85 63.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.493 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.534 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 17.5 mmmt -81.17 -24.72 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.222 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 66.5 mt -64.74 -61.81 1.96 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.135 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -175.09 112.78 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.545 0.212 . . . . 0.0 110.802 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.647 HG12 HG21 ' A' ' 57' ' ' THR . 9.2 p -170.3 32.24 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 121.969 0.89 . . . . 0.0 110.091 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.539 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 19.2 m -105.25 120.49 56.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 O-C-N 121.808 -0.557 . . . . 0.0 110.926 -175.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -75.39 -55.51 2.12 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.674 175.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.654 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.5 Cg_endo -97.26 -143.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 123.112 2.541 . . . . 0.0 113.071 -172.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -72.22 -1.34 14.78 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.593 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 144.14 -68.84 0.42 Allowed Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.164 -0.774 . . . . 0.0 111.164 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . 0.654 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -75.35 149.76 38.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.885 -0.657 . . . . 0.0 111.202 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.588 HD23 HD21 ' A' ' 67' ' ' ASN . 4.5 mm? 69.28 37.66 2.03 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.017 172.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.563 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.3 p80 -72.6 80.63 1.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.304 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.547 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 28.6 p-80 -87.39 -59.82 2.14 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.8 -63.48 4.58 Favored Glycine 0 N--CA 1.462 0.368 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.296 -170.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -57.47 -24.62 56.85 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -177.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.451 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -74.37 -36.07 63.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.435 0.636 . . . . 0.0 111.144 178.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.624 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.1 mmmt -79.48 -33.63 42.06 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.71 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.578 172.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.451 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 87.7 t80 -57.28 -37.11 71.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.354 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.89 75.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.858 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 54.1 mtt -66.86 -36.24 81.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.901 -175.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -87.63 -14.92 38.73 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.111 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -136.65 89.57 2.47 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.021 -175.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.1 -62.04 0.3 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.077 -1.058 . . . . 0.0 112.361 171.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.95 132.16 35.98 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 121.134 0.492 . . . . 0.0 110.833 -177.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.853 ' H ' ' HE3' ' A' ' 86' ' ' MET . 91.5 m-20 -75.01 149.42 39.27 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.97 -33.52 64.87 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.884 -174.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.39 -26.4 60.08 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 122.344 -0.223 . . . . 0.0 110.94 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' MET . . . . . 0.853 ' HE3' ' H ' ' A' ' 83' ' ' ASP . 17.9 mtm -86.38 -38.48 17.36 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -174.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.491 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -63.73 -42.6 97.88 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.883 175.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -75.58 -25.61 57.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -176.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.97 -23.89 44.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.607 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.626 ' HG ' HD12 ' A' ' 94' ' ' ILE . 60.0 tp -86.51 -48.17 8.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.244 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 16.8 m -57.69 -36.34 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.307 -174.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.02 -42.05 97.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.974 0.416 . . . . 0.0 110.091 -177.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.709 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mm -65.79 -42.34 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.896 175.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.626 HD12 ' HG ' ' A' ' 90' ' ' LEU . 58.5 mt -55.43 -47.42 78.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.965 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -70.06 -34.29 73.03 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.439 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -44.07 7.06 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.301 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.744 ' HB2' HG12 ' A' ' 114' ' ' VAL . 68.6 m -72.56 -34.4 67.46 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.472 ' HG3' ' CG1' ' A' ' 114' ' ' VAL . 8.3 mt-10 -64.52 -37.54 87.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.436 0.562 . . . . 0.0 111.069 170.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -67.38 -41.88 84.32 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.821 0.343 . . . . 0.0 110.512 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.4 m -94.68 14.41 21.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.924 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -80.76 150.43 69.44 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.91 159.94 50.97 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 122.606 2.204 . . . . 0.0 110.567 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.12 84.77 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.337 2.024 . . . . 0.0 111.232 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -126.29 108.81 11.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.992 -176.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -83.37 26.69 0.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -169.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.45 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 2.8 p30 -89.73 105.29 17.71 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 122.467 1.127 . . . . 0.0 111.642 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.5 tttp -29.28 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 114.674 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -84.61 -9.97 57.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.659 0.266 . . . . 0.0 111.525 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.864 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 91.7 mmm -85.12 -21.37 29.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -172.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.564 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -57.69 -45.31 85.83 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 122.095 0.95 . . . . 0.0 109.975 177.599 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.564 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.38 -12.49 3.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.261 174.227 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . 0.506 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.3 mp -89.52 -38.85 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.58 ' HA ' ' HE3' ' A' ' 116' ' ' MET . 13.8 m-20 -60.67 -36.94 79.99 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.767 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' VAL . . . . . 0.744 HG12 ' HB2' ' A' ' 97' ' ' CYS . 10.9 m -76.77 -38.21 29.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.91 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.06 -49.08 77.39 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 121.448 0.642 . . . . 0.0 111.546 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' MET . . . . . 0.668 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.13 -23.46 63.97 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.766 179.034 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' CYS . . . . . 0.563 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 9.3 t -69.43 -26.74 64.75 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 123.344 0.658 . . . . 0.0 109.529 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -75.3 -46.92 30.43 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.262 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.53 -25.63 65.02 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 118.345 -1.342 . . . . 0.0 111.15 178.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.668 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.37 -56.56 18.75 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 109.878 168.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 20.4 mm-40 -59.94 -42.73 94.66 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.507 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.452 HG22 ' HD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -56.52 -34.19 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 118.126 0.421 . . . . 0.0 111.351 177.235 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' HIS . . . . . 0.452 ' HD2' HG22 ' A' ' 122' ' ' ILE . 12.2 m170 -72.19 -31.93 66.34 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.088 -0.383 . . . . 0.0 111.39 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -69.53 -30.54 68.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.269 0.556 . . . . 0.0 110.419 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 97.8 mt -72.58 10.34 0.86 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.202 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -51.45 -48.25 62.83 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.373 0.269 . . . . 0.0 111.456 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.85 109.39 4.99 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-O 120.773 0.32 . . . . 0.0 110.213 177.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 27.7 m -96.99 151.95 38.04 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.583 178.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.19 -25.88 72.5 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.487 2.125 . . . . 0.0 111.585 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 63.9 t30 70.12 11.37 7.59 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.159 174.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.5 mmt -135.66 93.79 3.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.733 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -91.36 160.82 15.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.539 HD11 ' N ' ' A' ' 133' ' ' LEU . 0.0 OUTLIER -127.4 131.57 50.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.738 0.78 . . . . 0.0 111.358 -177.392 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.422 ' O ' ' HB ' ' A' ' 135' ' ' ILE . 3.1 m -134.84 116.68 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.827 -177.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . 0.422 ' HB ' ' O ' ' A' ' 134' ' ' VAL . 3.3 mp 73.93 111.12 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.037 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -118.27 12.43 12.64 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.898 -0.668 . . . . 0.0 111.886 178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 156.85 27.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.811 0.338 . . . . 0.0 110.748 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.63 112.57 22.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.058 -175.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.98 110.63 13.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -102.6 148.61 25.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.172 -177.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -141.99 137.95 31.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.331 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 45.1 t . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.253 -178.513 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.651 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.9 Cg_endo . . . . . 0 C--O 1.232 0.221 0 N-CA-C 112.855 0.29 . . . . 0.0 112.855 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.01 -69.07 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.568 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.46 HD12 ' HA ' ' A' ' 4' ' ' ILE . 6.6 tp -80.61 -9.71 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 121.132 0.491 . . . . 0.0 111.638 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.651 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 78.4 mtp -73.98 -21.18 60.09 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.47 176.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -74.1 91.68 2.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -73.04 131.84 42.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.52 -174.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 71.6 mt -55.99 -47.49 77.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.124 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.624 ' HB3' HD23 ' A' ' 55' ' ' LEU . 49.2 m -61.89 -29.97 70.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.438 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -75.27 -36.04 61.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.422 . . . . 0.0 110.295 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -68.71 -52.65 28.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.985 178.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -51.41 -78.01 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 173.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 55.5 35.49 61.74 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.631 -175.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -75.65 -41.17 54.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.071 0.436 . . . . 0.0 111.42 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.91 99.36 3.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.861 0.362 . . . . 0.0 111.227 -173.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.33 -46.68 14.35 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.255 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.07 -30.74 71.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.948 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -87.82 -21.99 24.74 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.727 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.2 t -75.21 -34.97 61.53 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 167.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.793 ' HA ' HD13 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -61.16 -45.58 94.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.897 178.834 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -71.16 -40.37 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.788 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.632 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 30.6 tp10 -60.09 -44.07 95.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.373 -0.131 . . . . 0.0 111.042 -173.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.726 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.4 mt -88.44 -8.58 54.7 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.496 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.5 m 57.68 37.57 27.36 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.133 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.793 HD13 ' HA ' ' A' ' 20' ' ' LYS . 5.0 mp -54.08 121.53 30.62 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.293 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.96 155.4 68.24 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.191 1.927 . . . . 0.0 110.878 172.641 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.68 -31.98 71.21 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.7 p -63.8 -40.4 96.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.707 0.289 . . . . 0.0 111.444 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.5 t -76.21 -55.73 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.643 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -59.61 -28.79 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.935 0.398 . . . . 0.0 110.865 -176.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.56 -51.43 35.49 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.29 -35.98 82.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.318 0.58 . . . . 0.0 110.031 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -38.62 69.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.395 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -78.54 8.9 4.53 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.473 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 43.7 t30 -65.65 107.74 1.84 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.709 0.686 . . . . 0.0 109.747 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -81.16 -18.38 46.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.227 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.473 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 30.4 m-90 -73.45 131.71 42.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -80.71 53.29 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.125 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.571 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 37.7 t70 -43.73 -42.67 5.55 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 172.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.4 t70 66.36 61.31 0.59 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-O 121.716 0.769 . . . . 0.0 109.929 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.571 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -97.28 177.32 5.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.107 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.2 t -84.29 126.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.74 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 37.5 ttm -67.11 103.46 1.2 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.0 p -101.72 -26.74 13.39 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -173.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 15.3 t70 -101.62 122.51 44.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.69 0.757 . . . . 0.0 112.493 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 1.023 ' HB2' ' HB3' ' A' ' 108' ' ' CYS . 0.1 OUTLIER -47.59 -40.94 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.132 172.432 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.807 HD22 ' HG2' ' A' ' 46' ' ' ARG . 2.9 mm? -65.87 -19.24 65.81 Favored 'General case' 0 C--N 1.333 -0.144 0 O-C-N 122.021 -0.425 . . . . 0.0 111.068 -176.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.08 -61.24 1.96 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -39.12 -48.13 2.65 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 114.688 -1.142 . . . . 0.0 114.504 168.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.5 m -67.31 -41.95 84.51 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.405 1.102 . . . . 0.0 111.674 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -63.24 -23.86 67.61 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.9 mt -58.09 -39.23 71.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.992 0.425 . . . . 0.0 110.946 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.489 ' O ' ' HB ' ' A' ' 57' ' ' THR . 3.7 p-10 -113.84 42.84 1.93 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.481 0.658 . . . . 0.0 110.16 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 10.6 t -98.75 -46.4 5.69 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.656 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 9' ' ' SER . 4.4 mm? -60.31 -55.88 28.24 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 111.963 -174.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.09 -16.62 49.41 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.909 -172.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 53' ' ' ASN . 18.1 m -84.93 -42.37 15.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.372 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.632 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 5.8 mmmt -72.76 -15.97 61.65 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.373 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.84 -65.92 0.61 Allowed 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 172.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -176.28 119.14 0.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.056 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.466 ' CG1' HG23 ' A' ' 57' ' ' THR . 9.2 p -175.62 31.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 121.54 0.686 . . . . 0.0 111.327 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.545 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 32.9 m -93.34 118.72 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 O-C-N 121.147 -0.971 . . . . 0.0 111.401 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.31 -53.27 10.67 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.505 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.681 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -98.99 -143.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 123.345 2.696 . . . . 0.0 112.999 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 6.3 p-10 -72.21 -5.72 37.8 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.633 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 151.41 -60.96 0.41 Allowed Glycine 0 C--N 1.316 -0.572 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.681 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -85.36 165.48 17.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.815 -0.692 . . . . 0.0 109.817 176.971 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.09 29.79 4.62 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.308 0.575 . . . . 0.0 111.308 171.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.577 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 9.2 p80 -73.4 74.3 1.38 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.192 0.52 . . . . 0.0 111.794 177.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -86.38 -50.86 6.6 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.13 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.4 -61.71 6.58 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.948 -172.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -56.68 -31.08 64.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.67 -37.95 76.89 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.219 0.533 . . . . 0.0 110.968 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -79.73 -35.59 38.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.0 -40.96 95.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.457 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -63.57 -38.78 92.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.663 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.09 78.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.066 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 72.0 mtm -73.63 -23.46 59.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.812 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -93.22 -14.26 27.31 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.935 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -144.99 95.41 2.68 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 120.742 0.306 . . . . 0.0 111.042 -177.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.38 -70.11 0.42 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.236 173.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -103.72 135.4 45.34 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.4 ' OD1' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -80.21 172.56 13.61 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.197 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -23.25 67.16 Favored 'General case' 0 N--CA 1.422 -1.872 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.604 -167.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 1.2 t -73.19 -30.9 63.86 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.481 -177.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.581 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 71.9 mtp -81.93 -41.2 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.376 0.608 . . . . 0.0 109.362 -175.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.583 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -62.29 -33.23 74.25 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.235 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.74 -21.45 51.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.25 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.816 ' HG2' ' O ' ' A' ' 85' ' ' THR . 10.6 mm-40 -77.74 -25.31 49.14 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 172.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.2 mp -85.45 -42.94 14.03 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.604 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.583 HG13 ' O ' ' A' ' 87' ' ' ALA . 29.8 m -56.91 -32.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.86 0.362 . . . . 0.0 111.809 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.17 -44.91 78.52 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.601 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.636 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.5 mp -67.62 -43.75 86.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 50.0 mt -52.67 -48.7 48.16 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.786 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -71.7 -36.54 70.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.196 -174.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.33 -44.4 6.6 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 119.722 -1.228 . . . . 0.0 112.367 -172.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.739 ' HB2' HG12 ' A' ' 114' ' ' VAL . 38.7 m -72.23 -41.11 67.2 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.854 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.501 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.4 tt0 -63.89 -38.79 92.4 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 117.948 0.34 . . . . 0.0 110.798 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -67.14 -34.46 77.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 m -95.79 5.34 51.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.259 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.33 149.44 78.91 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.719 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.474 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 22.7 Cg_exo -65.37 144.53 80.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.731 2.287 . . . . 0.0 111.195 178.009 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 7.9 Cg_exo -73.37 35.52 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.425 2.75 . . . . 0.0 113.314 -175.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -76.77 112.08 12.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -77.75 96.22 4.85 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -167.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.74 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.0 t0 -144.04 100.73 3.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 163.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -40.77 -44.75 2.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' A' ' 46' ' ' ARG . 4.1 t -88.06 -24.58 23.41 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.583 1.083 . . . . 0.0 112.232 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.74 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 75.4 mmm -74.76 -26.39 59.73 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.987 -0.445 . . . . 0.0 111.884 -175.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.556 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -60.14 -43.03 96.04 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.766 0.793 . . . . 0.0 110.032 178.192 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.556 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.03 -14.9 7.46 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.35 174.418 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.565 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.5 mp -89.95 -38.0 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 14.4 t70 -60.06 -34.11 72.97 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.432 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.739 HG12 ' HB2' ' A' ' 97' ' ' CYS . 14.0 m -80.57 -39.47 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.574 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.75 -49.64 76.68 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.323 0.582 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.718 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.84 -24.67 63.49 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.305 178.918 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.4 t -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.171 0.51 . . . . 0.0 110.137 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.568 ' HA ' HG12 ' A' ' 93' ' ' ILE . 73.7 t80 -79.65 -45.87 18.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.123 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -69.27 -28.8 66.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.71 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.718 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.54 -51.06 71.48 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.916 0.389 . . . . 0.0 110.452 170.349 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -57.52 -54.9 41.64 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.67 177.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.14 -32.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 120.699 0.285 . . . . 0.0 111.44 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -71.22 -30.63 66.59 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.625 ' HE2' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.28 -33.07 67.17 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.796 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.56 172.471 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.679 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 18.5 Cg_endo . . . . . 0 N--CA 1.475 0.404 0 N-CA-C 114.384 0.878 . . . . 0.0 114.384 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.5 -69.13 0.12 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.72 0.295 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.88 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.2 mm -80.16 -15.08 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-O 121.092 0.472 . . . . 0.0 111.676 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.679 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 13.4 tmm? -64.64 -38.2 90.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.016 0.436 . . . . 0.0 110.267 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -93.45 120.38 33.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.36 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -71.79 133.83 45.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.789 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.604 HD11 ' O ' ' A' ' 80' ' ' HIS . 50.7 mt -57.7 -43.15 84.97 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.035 0.209 . . . . 0.0 110.914 178.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.0 m -61.79 -38.72 89.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.897 0.379 . . . . 0.0 110.763 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -75.47 -34.56 60.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.4 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -67.19 -54.05 24.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.678 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HD2' ' O ' ' A' ' 8' ' ' LEU . 32.9 m-85 -47.45 -73.02 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.459 168.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.01 40.23 58.18 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.306 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.459 ' HD3' ' C ' ' A' ' 14' ' ' LYS . 12.2 tmtt? -67.48 -58.14 5.27 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.1 90.46 1.36 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.684 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 64.6 mtt -71.62 -27.19 62.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.251 0.548 . . . . 0.0 109.773 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 37.3 t70 -62.27 -24.69 67.42 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.799 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -88.13 -25.14 23.14 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.197 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.6 t -76.13 -36.58 58.74 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.76 -42.09 97.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.462 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -71.3 -42.85 68.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.088 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -70.24 -41.46 73.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.352 -174.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' A' ' 25' ' ' LEU . 15.3 mt -83.48 1.17 43.1 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.972 0.415 . . . . 0.0 111.291 -177.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.8 m 67.38 31.92 6.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.721 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' A' ' 23' ' ' LEU . 8.4 mp -62.15 121.4 65.78 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.724 175.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 12.5 Cg_exo -71.07 160.22 49.91 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.89 2.393 . . . . 0.0 111.167 173.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.767 ' HA ' HG22 ' A' ' 30' ' ' VAL . 4.6 p-10 -69.4 -16.42 63.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.34 -176.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 p -64.85 -48.83 72.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 0.0 110.341 174.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.2 t -71.0 -45.82 70.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.256 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.767 HG22 ' HA ' ' A' ' 27' ' ' ASP . 14.9 m -59.28 -30.04 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.975 0.417 . . . . 0.0 110.043 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.54 -52.19 54.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.798 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.02 -36.11 81.38 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.104 0.478 . . . . 0.0 110.202 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -54.99 25.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.177 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -66.95 11.08 0.11 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -64.36 118.27 8.46 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.02 1.282 . . . . 0.0 110.063 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -92.55 -36.33 13.09 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -77.39 151.18 34.94 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.217 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -80.13 60.24 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.951 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -55.49 -36.33 66.52 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.713 171.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.1 t0 59.41 70.92 0.61 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.51 0.671 . . . . 0.0 110.087 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.414 ' HD1' ' O ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.22 164.66 11.57 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.68 -179.283 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.2 t -85.44 115.16 26.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 173.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.617 ' O ' HG21 ' A' ' 112' ' ' ILE . 39.4 ttp -72.49 99.08 2.41 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.028 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.8 p -110.48 -9.99 14.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.839 -175.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -80.41 134.22 35.98 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.851 0.834 . . . . 0.0 110.443 178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.723 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 6.2 mpt_? -72.99 -29.12 62.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.227 -1.352 . . . . 0.0 110.681 -170.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB3' ' HG ' ' A' ' 25' ' ' LEU . 3.3 mm? -76.13 -15.25 60.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.495 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.582 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -84.46 -58.73 2.62 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.8 -47.53 1.8 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.187 -0.915 . . . . 0.0 114.096 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.423 ' HB3' HD13 ' A' ' 23' ' ' LEU . 7.3 m -66.55 -43.93 83.72 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.292 1.046 . . . . 0.0 111.641 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.705 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -67.82 -23.97 65.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.87 0.367 . . . . 0.0 111.861 -177.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 48' ' ' ALA . 37.2 mm -65.6 -32.41 58.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.981 0.42 . . . . 0.0 110.835 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.5 p30 -132.12 53.7 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.499 -176.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.576 ' SG ' HD12 ' A' ' 55' ' ' LEU . 25.8 p -115.16 -44.05 3.04 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.59 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' SG ' ' A' ' 54' ' ' CYS . 9.0 mp -54.52 -44.0 72.4 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.197 0.523 . . . . 0.0 111.534 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.407 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -79.8 -11.74 59.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.318 -173.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.806 ' HA ' ' CG1' ' A' ' 61' ' ' VAL . 13.2 m -83.63 -33.17 25.35 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.646 0.736 . . . . 0.0 110.211 174.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 13.3 mmmt -71.26 -31.48 67.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.249 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.95 -67.07 0.47 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.72 172.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -178.97 123.21 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.546 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.806 ' CG1' ' HA ' ' A' ' 57' ' ' THR . 7.9 p -177.42 32.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.431 0.634 . . . . 0.0 112.171 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.537 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.1 m -101.34 123.22 54.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.691 -1.256 . . . . 0.0 111.42 -177.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.462 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 12.3 t70 -73.5 -54.29 4.09 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.891 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.74 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 57.0 Cg_endo -104.62 -139.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 123.398 2.732 . . . . 0.0 113.066 -171.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.52 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 18.3 m-20 -73.25 3.0 6.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.673 -175.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.41 -75.47 0.33 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.785 -0.722 . . . . 0.0 111.35 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.685 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p30 -76.53 157.05 32.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.183 -0.508 . . . . 0.0 110.742 177.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 69.49 34.17 2.89 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.585 0.553 . . . . 0.0 111.22 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.74 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.7 p80 -73.71 79.98 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.439 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -87.69 -57.25 3.01 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.424 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.12 -63.08 5.03 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.086 -169.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -59.36 -22.86 61.96 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.435 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -72.7 -33.83 66.74 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.965 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 29.8 mmmt -78.82 -31.62 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.059 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -64.96 -39.97 94.29 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.407 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 88.7 t80 -61.64 -36.89 82.08 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.704 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.17 -40.85 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.828 0.346 . . . . 0.0 110.991 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.563 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 73.9 mtm -75.18 -19.76 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.199 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -90.13 -16.26 29.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.231 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.604 ' O ' HD11 ' A' ' 8' ' ' LEU . 48.9 m80 -143.27 96.34 2.9 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.653 0.263 . . . . 0.0 110.37 -175.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.85 -62.64 0.3 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.125 172.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.88 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.43 139.74 38.93 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.046 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.474 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.7 OUTLIER -82.25 169.02 17.03 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 168.641 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 12.2 pt-20 -68.09 -22.65 64.9 Favored 'General case' 0 N--CA 1.409 -2.487 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.298 -165.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.474 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.4 t -73.22 -29.43 62.79 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.08 -175.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 61.1 mtm -87.22 -38.82 16.01 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.61 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.21 -37.64 80.93 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.321 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -77.2 -21.85 53.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.275 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -77.23 -22.12 52.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.027 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 94' ' ' ILE . 28.8 tp -88.26 -39.38 14.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.65 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.2 m -57.59 -35.92 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -171.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.71 -38.13 83.18 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.036 -175.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.895 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.5 mp -65.79 -39.59 85.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 171.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.6 mt -58.04 -48.19 84.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.988 -178.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -70.93 -36.4 72.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.517 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.12 -46.09 6.02 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.17 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 93' ' ' ILE . 48.7 m -72.73 -38.27 67.49 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 116.494 0.147 . . . . 0.0 110.919 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.55 -39.3 76.35 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.295 -0.253 . . . . 0.0 110.983 170.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -74.33 -43.01 58.48 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.144 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.1 m -94.57 14.55 20.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.708 -173.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.21 151.39 81.71 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.472 ' C ' ' H ' ' A' ' 104' ' ' ASN . 51.5 Cg_exo -56.63 163.26 7.23 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.924 2.416 . . . . 0.0 112.189 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.92 33.34 0.13 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.482 2.788 . . . . 0.0 113.168 177.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.472 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.4 m-20 -121.81 101.9 7.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -79.56 96.12 6.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.99 0.9 . . . . 0.0 109.546 178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -90.42 104.73 17.27 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.619 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -31.29 -77.26 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 O-C-N 124.824 1.328 . . . . 0.0 113.735 -169.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 42.2 t -95.91 -11.08 27.21 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.826 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 1.9 tmm? -86.89 -16.34 36.3 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 112.613 -169.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.562 ' HG3' ' H ' ' A' ' 111' ' ' THR . 22.5 pttt -55.59 -45.94 77.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.769 0.795 . . . . 0.0 111.068 -173.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.626 HG23 HD12 ' A' ' 112' ' ' ILE . 12.6 t -57.33 -13.73 3.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.426 -1.261 . . . . 0.0 112.843 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -90.45 -37.35 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -58.09 -37.03 73.73 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.687 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -79.42 -36.48 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.38 0.609 . . . . 0.0 110.447 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.19 70.64 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.373 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.698 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 19.5 ptt? -69.59 -17.89 63.58 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.201 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 53.0 t -73.26 -22.36 60.41 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.895 ' HB2' HG21 ' A' ' 93' ' ' ILE . 54.2 t80 -81.0 -46.3 15.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.686 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.29 -17.52 63.09 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 118.309 -1.356 . . . . 0.0 109.397 175.854 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.698 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.47 -55.3 21.67 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.149 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 8.0 mm-40 -58.95 -51.3 70.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.642 175.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.33 -32.9 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 178.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -70.9 -32.8 69.86 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.038 -0.413 . . . . 0.0 112.057 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -73.76 -34.37 64.68 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.441 0.638 . . . . 0.0 109.959 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 79.1 mt . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.936 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.401 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.4 Cg_endo . . . . . 0 CA--C 1.528 0.196 0 CA-C-O 120.526 0.136 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.29 -66.47 0.39 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.044 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tp -75.36 -15.6 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 121.17 0.51 . . . . 0.0 111.517 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.401 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 73.7 mtp -76.84 -40.61 47.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -80.12 97.05 6.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.91 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -62.38 123.27 17.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.342 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.07 -36.41 77.29 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.286 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 m -60.29 -34.64 74.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -75.0 -32.76 61.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.019 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -67.92 -45.06 75.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.721 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -57.1 -86.5 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 169.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.81 37.91 44.41 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.492 -178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -61.45 -59.31 5.44 Favored 'General case' 0 C--N 1.335 -0.042 0 CA-C-O 121.227 0.536 . . . . 0.0 110.437 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.45 100.55 3.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.965 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.508 ' HG2' ' OH ' ' A' ' 34' ' ' TYR . 17.0 tpt -74.61 -22.3 59.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.759 -178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -53.89 -31.53 50.21 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.473 -175.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 26.3 mt-30 -87.42 -21.33 25.66 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.834 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 32.1 t -75.27 -36.17 61.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 170.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.77 ' HA ' HD23 ' A' ' 25' ' ' LEU . 29.7 tptp -58.27 -51.07 71.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.636 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.13 -47.79 48.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.91 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.519 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 5.8 mm-40 -69.7 -32.28 70.79 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 54' ' ' CYS . 1.5 mm? -90.6 -21.46 21.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 61.91 50.28 4.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.117 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -63.12 125.7 87.48 Favored Pre-proline 0 CA--C 1.52 -0.188 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.959 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.7 Cg_exo -64.68 150.6 87.92 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.696 1.597 . . . . 0.0 109.4 168.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -54.99 -33.82 62.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.909 0.385 . . . . 0.0 111.676 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -78.58 -29.84 46.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.004 -174.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.434 HG11 ' CB ' ' A' ' 47' ' ' LEU . 26.1 t -77.22 -49.44 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 121.101 -0.24 . . . . 0.0 111.303 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.5 p -60.43 -27.36 39.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 121.114 0.483 . . . . 0.0 109.811 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.91 -52.02 33.77 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.699 173.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -63.65 -33.29 75.29 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.321 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.1 tp -51.02 -55.46 17.36 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.722 170.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.508 ' OH ' ' HG2' ' A' ' 16' ' ' MET . 18.4 m-85 -68.51 12.15 0.14 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 176.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.56 123.33 16.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 119.859 1.208 . . . . 0.0 110.419 -173.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -72.26 -36.24 68.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.719 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.2 m-90 -92.9 101.82 14.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.245 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -76.37 78.17 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.186 0.517 . . . . 0.0 109.896 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.549 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 34.5 t70 -62.51 12.1 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.0 t0 53.81 43.05 31.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.227 0.921 . . . . 0.0 110.047 -174.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.549 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 13.1 p90 -86.7 175.02 8.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.981 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -95.59 125.63 48.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.463 ' HE1' HD11 ' A' ' 52' ' ' ILE . 42.6 ttm -68.45 103.65 1.71 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.058 0.456 . . . . 0.0 110.251 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.9 p -93.31 -39.47 10.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.842 -174.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -83.57 134.56 34.81 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.924 0.868 . . . . 0.0 111.025 -176.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 4.2 mpt_? -74.98 -30.14 61.09 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.11 -1.404 . . . . 0.0 110.149 -173.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.625 HD12 HD13 ' A' ' 25' ' ' LEU . 3.7 mm? -66.55 -15.23 63.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.796 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.505 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.74 -56.76 3.93 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.582 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.33 -47.29 3.61 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-N 114.933 -1.03 . . . . 0.0 114.58 165.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 20.8 m -66.28 -44.52 83.33 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 118.786 1.293 . . . . 0.0 110.28 -178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.18 -17.3 63.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.553 -175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 48' ' ' ALA . 71.4 mt -54.37 -37.76 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.083 0.468 . . . . 0.0 110.22 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -143.79 71.96 1.34 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.317 0.58 . . . . 0.0 109.725 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.481 ' HB2' HD21 ' A' ' 23' ' ' LEU . 23.1 p -104.52 -45.93 4.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.385 176.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.4 tp -62.37 -47.28 84.86 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.417 -176.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.84 -16.25 51.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.904 0.383 . . . . 0.0 110.772 -173.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.48 HG23 ' CG1' ' A' ' 61' ' ' VAL . 55.3 m -84.06 -36.93 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.587 174.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 15.6 mmmt -68.31 -25.0 64.9 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.246 -0.284 . . . . 0.0 111.273 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.3 mt -64.49 -66.09 0.59 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 121.098 -0.241 . . . . 0.0 110.934 176.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -176.76 121.83 0.14 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.515 0.198 . . . . 0.0 110.744 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 57' ' ' THR . 13.9 p -173.29 50.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.256 1.027 . . . . 0.0 110.267 -176.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.59 ' HA ' ' HB2' ' A' ' 69' ' ' HIS . 1.5 m -110.1 125.8 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 121.601 -0.687 . . . . 0.0 111.249 -173.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -76.78 -56.14 1.4 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.265 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 16.4 Cg_endo -98.34 -139.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.504 2.803 . . . . 0.0 112.851 -171.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.502 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 28.8 t70 -71.5 -1.5 13.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.512 -177.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.44 -65.57 0.5 Allowed Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.34 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p-10 -76.31 149.57 37.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.549 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 68.6 40.67 1.83 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.318 0.58 . . . . 0.0 111.176 174.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 62' ' ' VAL . 8.3 p80 -74.73 69.54 1.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.511 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -82.22 -50.71 8.69 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.91 -56.16 26.34 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.837 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.68 -27.75 66.68 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.38 -36.71 66.12 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.454 0.645 . . . . 0.0 110.722 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -78.65 -37.85 41.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.68 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 18.9 t70 -66.72 -32.49 73.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.464 173.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -57.69 -42.04 82.88 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.995 0.426 . . . . 0.0 110.126 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 -34.86 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.679 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 72.7 mtm -74.42 -26.49 60.11 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.597 ' HD3' ' CE1' ' A' ' 80' ' ' HIS . 4.8 ptpp? -93.03 -18.47 22.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.714 -0.795 . . . . 0.0 110.933 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.597 ' CE1' ' HD3' ' A' ' 79' ' ' LYS . 6.4 m-70 -134.53 91.44 2.78 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 124.31 -74.52 0.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.705 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -91.74 132.61 36.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.867 0.365 . . . . 0.0 111.315 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.484 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -85.11 173.57 10.36 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -59.59 -34.45 72.75 Favored 'General case' 0 N--CA 1.418 -2.058 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -170.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.795 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 5.2 t -63.61 -31.42 72.59 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.362 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 46.1 mtt -82.5 -39.66 22.14 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -64.23 -37.32 87.07 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.556 177.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.453 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -75.69 -26.17 57.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.502 -175.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 85' ' ' THR . 54.2 mm-40 -80.14 -24.26 40.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.67 172.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 94' ' ' ILE . 42.0 tp -84.15 -46.38 11.97 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.085 -176.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.453 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.2 m -56.88 -36.76 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.869 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.58 -43.53 80.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.437 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.731 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.6 mp -69.11 -43.32 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.245 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.7 mt -55.65 -47.79 78.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.669 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -71.06 -35.16 71.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.698 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.15 -45.25 6.32 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.491 -173.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' A' ' 93' ' ' ILE . 60.1 m -72.65 -37.05 68.09 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.117 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.09 -39.32 93.81 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.282 0.492 . . . . 0.0 110.719 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.92 -34.15 77.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.08 0.467 . . . . 0.0 110.48 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 m -104.09 17.19 24.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.973 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.76 155.97 67.95 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.252 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.06 143.84 91.68 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.968 1.779 . . . . 0.0 110.473 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.55 72.28 0.43 Allowed 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.665 2.243 . . . . 0.0 112.908 -176.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -125.62 95.21 4.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.823 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -76.51 96.31 4.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.191 0.519 . . . . 0.0 111.321 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 1.074 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.2 t70 -143.92 120.34 10.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.756 174.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.566 ' NZ ' ' HB2' ' A' ' 107' ' ' LYS . 3.9 ttmp? -34.68 -60.84 0.42 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 178.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.418 ' O ' HD13 ' A' ' 112' ' ' ILE . 5.9 m -89.51 -10.13 47.42 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . 1.074 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 1.3 tmm? -69.03 -42.97 75.65 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-O 122.214 1.007 . . . . 0.0 110.092 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.591 ' HG3' ' H ' ' A' ' 111' ' ' THR . 14.4 ptpt -64.92 -49.98 68.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.169 -1.378 . . . . 0.0 111.342 -172.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.591 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 11.6 t -57.98 -14.98 7.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.68 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.582 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.5 mp -91.66 -40.71 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 8.5 t70 -61.94 -34.91 76.96 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.078 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.662 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.1 m -81.53 -37.38 15.36 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.865 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.2 -51.78 68.1 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-O 120.817 0.341 . . . . 0.0 111.795 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.651 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.43 -26.02 64.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.015 179.635 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 32.3 t -68.52 -24.76 64.69 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.112 0.482 . . . . 0.0 109.837 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 93' ' ' ILE . 37.8 t80 -77.31 -49.73 14.37 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.845 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -23.65 61.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.824 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.92 -54.43 46.27 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 118.869 0.758 . . . . 0.0 109.367 167.469 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.442 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 6.8 tp10 -58.07 -50.4 73.6 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.87 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.85 -32.89 22.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 117.742 0.246 . . . . 0.0 111.161 177.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -71.29 -32.88 69.17 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -78.47 -31.26 47.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 0.0 109.862 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 91.4 mt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.52 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.2 Cg_exo . . . . . 0 CA--C 1.528 0.191 0 N-CA-C 112.552 0.174 . . . . 0.0 112.552 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -50.03 -67.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 111.341 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.896 HD11 ' HB2' ' A' ' 82' ' ' ALA . 23.4 mm -76.17 -16.25 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 121.066 0.46 . . . . 0.0 111.326 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.446 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 5.2 tmm? -68.4 -43.62 76.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.517 ' HE3' ' OD1' ' A' ' 11' ' ' ASN . 41.9 tptt -80.73 85.54 6.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.356 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.465 ' OD1' ' HB2' ' A' ' 10' ' ' ASN . 3.0 p30 -62.65 125.55 24.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.218 -175.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.704 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.9 pt? -61.85 -30.2 70.69 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.506 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -61.6 -41.49 97.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.796 0.331 . . . . 0.0 110.855 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.465 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m120 -78.05 -18.9 55.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.13 176.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.603 ' ND2' ' HA ' ' A' ' 8' ' ' LEU . 96.9 m-20 -66.51 -52.18 48.73 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -57.21 -84.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.941 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.54 34.79 35.7 Favored Glycine 0 C--N 1.344 0.989 0 C-N-CA 121.356 -0.45 . . . . 0.0 114.111 178.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.97 -56.27 23.75 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 117.272 0.536 . . . . 0.0 111.163 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -144.64 107.31 4.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.886 0.374 . . . . 0.0 110.879 -177.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.7 mtm -70.18 -32.5 70.47 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.747 0.308 . . . . 0.0 110.818 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.7 -22.8 67.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.915 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.638 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 3.2 pt20 -83.94 -27.02 28.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.077 -176.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.8 t -75.47 -35.64 60.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 173.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.32 -48.28 80.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.043 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.75 -44.13 43.21 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.276 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -63.3 -41.82 99.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.452 0.168 . . . . 0.0 111.262 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' HD22 ' A' ' 25' ' ' LEU . 3.4 mm? -79.21 -22.82 44.34 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.8 m 60.83 50.02 5.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.301 -175.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.6 mm? -61.29 131.08 92.14 Favored Pre-proline 0 N--CA 1.461 0.122 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 5.8 Cg_exo -73.69 154.24 49.17 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.144 1.896 . . . . 0.0 110.441 168.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.587 ' HA ' HG22 ' A' ' 30' ' ' VAL . 0.9 OUTLIER -65.98 -26.98 67.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.018 0.437 . . . . 0.0 110.801 -176.077 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -63.37 -40.67 97.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.279 0.561 . . . . 0.0 110.073 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.519 HG11 ' HB2' ' A' ' 47' ' ' LEU . 24.4 t -77.22 -43.8 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.342 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.7 m -56.02 -37.24 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 121.157 0.503 . . . . 0.0 109.997 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.19 -51.91 58.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.672 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.63 -37.1 86.41 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.163 0.506 . . . . 0.0 110.524 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -43.48 95.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.02 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.0 9.68 2.81 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -65.93 131.56 46.55 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.048 0.84 . . . . 0.0 110.666 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -91.1 -7.72 50.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.994 0.425 . . . . 0.0 110.903 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 6.9 m-90 -91.15 102.38 15.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.687 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -90.52 65.46 6.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -62.77 12.58 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.2 t0 54.54 71.52 0.52 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.559 1.072 . . . . 0.0 109.75 -169.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -115.34 157.12 24.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.245 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 67.1 t -86.2 116.15 28.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 48' ' ' ALA . 55.3 tpp -71.26 103.71 2.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.566 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -99.94 -9.13 23.13 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -90.39 127.78 36.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 109.718 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.606 ' HD3' ' N ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -78.48 -19.59 52.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.288 -170.15 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -75.76 -19.37 59.07 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.228 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HB3' ' SD ' ' A' ' 43' ' ' MET . . . -85.29 -59.07 2.43 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.42 -47.68 2.86 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-N 115.176 -0.92 . . . . 0.0 114.083 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 m -65.4 -45.49 83.78 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 118.207 1.003 . . . . 0.0 111.619 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.14 -3.06 24.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.0 mm -59.73 -35.78 61.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.016 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -145.2 82.65 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 173.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 21.4 p -108.79 -45.53 3.8 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.889 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.488 HD11 ' H ' ' A' ' 15' ' ' ALA . 6.7 tt -63.99 -44.43 92.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.932 -174.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.63 55.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.037 0.446 . . . . 0.0 110.371 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.47 HG23 HG11 ' A' ' 61' ' ' VAL . 43.6 m -80.9 -32.0 34.96 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.581 175.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 19.2 mmmt -82.04 -16.75 49.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.846 177.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.2 mt -66.71 -67.17 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 171.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -178.1 127.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.47 HG11 HG23 ' A' ' 57' ' ' THR . 9.3 p -172.56 32.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 122.109 0.957 . . . . 0.0 109.778 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.0 m -102.79 120.95 53.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 O-C-N 121.769 -0.582 . . . . 0.0 111.605 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.3 -56.78 5.06 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.427 174.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 17.8 Cg_endo -100.74 -140.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.355 2.703 . . . . 0.0 113.271 -170.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.514 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 24.1 m-20 -75.3 5.49 5.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.58 -175.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 139.75 -75.46 0.36 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -177.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.67 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.0 p30 -69.07 156.77 38.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.827 -0.686 . . . . 0.0 110.901 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 68' ' ' LEU . 4.0 mm? 70.05 29.21 3.91 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.266 0.626 . . . . 0.0 112.533 174.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.594 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.6 p-80 -78.08 67.57 3.95 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.254 0.549 . . . . 0.0 111.284 174.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.452 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 44.7 p-80 -86.61 -45.74 10.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.837 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.96 -55.36 30.77 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.317 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -59.94 -28.39 67.58 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.705 -0.248 . . . . 0.0 111.488 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.62 -34.98 74.83 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.345 0.593 . . . . 0.0 110.983 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 70.5 mmtt -78.56 -37.32 43.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 109.241 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.77 -40.01 94.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.637 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -62.59 -34.06 76.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.073 177.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.08 -32.08 69.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.994 177.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 89.1 mtp -70.67 -35.14 72.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.778 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -90.28 -14.83 32.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.478 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.456 ' O ' HD13 ' A' ' 8' ' ' LEU . 70.3 m-70 -140.05 92.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.361 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.29 -73.59 0.46 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.876 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.896 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.39 145.26 30.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.959 0.409 . . . . 0.0 111.248 -175.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -87.78 177.13 7.09 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.027 175.205 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -40.45 65.56 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.38 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.727 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 13.0 t -72.12 -33.55 67.9 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.119 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.483 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 68.6 mtp -81.4 -39.15 25.43 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 121.96 -0.463 . . . . 0.0 109.886 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -60.22 -37.92 81.78 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 173.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.438 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.36 -24.93 60.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.685 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.727 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.2 mm-40 -79.87 -25.92 40.5 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.404 -0.518 . . . . 0.0 109.898 173.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 22.7 tp -87.62 -44.2 11.4 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.954 -174.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 87' ' ' ALA . 14.5 m -57.24 -36.03 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.179 -176.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.41 -44.18 95.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.952 0.406 . . . . 0.0 110.181 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.449 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -68.32 -42.38 84.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.234 175.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 57.8 mt -54.87 -49.2 72.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.307 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -70.77 -35.12 72.45 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.487 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.4 -56.39 2.84 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.26 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 21.7 m -72.73 -29.73 63.59 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.17 -34.17 76.97 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.631 0.651 . . . . 0.0 110.108 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -70.39 -42.96 71.02 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.832 0.349 . . . . 0.0 111.137 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -94.08 10.37 33.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.763 0.316 . . . . 0.0 111.688 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB1' ' HD2' ' A' ' 102' ' ' PRO . . . -64.53 156.3 77.93 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.445 ' HD2' ' HB1' ' A' ' 101' ' ' ALA . 9.8 Cg_endo -50.87 156.4 4.74 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.251 2.634 . . . . 0.0 112.464 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.7 Cg_exo -68.68 24.48 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.555 2.837 . . . . 0.0 113.496 -175.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 102' ' ' PRO . 17.0 m120 -110.79 105.12 13.86 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.54 84.95 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.159 0.504 . . . . 0.0 109.944 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.8 t70 -101.17 103.94 15.0 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.563 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -37.58 -50.39 1.14 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 114.317 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.556 ' O ' HG22 ' A' ' 111' ' ' THR . 5.4 t -95.26 -20.93 18.78 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.037 0.835 . . . . 0.0 113.189 -176.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.736 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 56.2 mmm -74.55 -29.07 61.22 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.026 0.83 . . . . 0.0 112.334 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 111' ' ' THR . 27.5 pttt -56.34 -45.45 80.39 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.492 -172.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 108' ' ' CYS . 14.6 t -57.61 -16.36 10.13 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.711 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.538 ' O ' ' HG3' ' A' ' 116' ' ' MET . 3.1 mp -90.07 -37.2 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.43 -37.98 79.5 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.865 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.95 -37.45 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.55 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.01 -52.67 64.01 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.538 ' HG3' ' O ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -69.72 -19.73 63.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.396 178.681 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.588 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 5.0 t -71.58 -30.62 66.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.493 173.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.417 ' HA ' HG12 ' A' ' 93' ' ' ILE . 86.7 t80 -76.78 -45.95 26.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.794 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' HG22 ' A' ' 122' ' ' ILE . 3.3 pttp -70.32 -30.0 66.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.357 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.588 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -66.69 -44.44 81.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.179 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 23.9 mm-40 -59.01 -53.54 57.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.172 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.524 ' HA ' HD12 ' A' ' 125' ' ' LEU . 8.5 tt -55.74 -32.93 32.74 Favored 'Isoleucine or valine' 0 C--N 1.345 0.4 0 CA-C-N 118.023 0.374 . . . . 0.0 111.401 -178.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -71.3 -33.37 69.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.2 ttpt -76.59 -15.58 59.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.238 0.542 . . . . 0.0 110.7 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 87.0 mt . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.601 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.647 ' O ' ' HG2' ' A' ' 6' ' ' LYS . 36.2 Cg_exo . . . . . 0 N--CA 1.473 0.267 0 N-CA-C 113.578 0.568 . . . . 0.0 113.578 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -45.02 -69.52 0.13 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.544 0.527 . . . . 0.0 112.133 -176.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.606 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -87.2 -9.09 11.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.415 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 75.4 mtp -74.93 -25.6 59.01 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -177.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 2' ' ' PRO . 21.3 pttp -97.03 89.26 4.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.449 0.642 . . . . 0.0 109.721 173.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.02 125.18 24.09 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.003 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -59.32 -33.85 71.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.781 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -61.86 -38.07 86.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.164 0.507 . . . . 0.0 110.082 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -75.39 -30.91 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.302 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.24 -55.99 10.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.296 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -47.78 -74.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.034 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLY . . . . . 0.621 ' HA2' ' HG3' ' A' ' 16' ' ' MET . . . 54.65 33.48 55.03 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.219 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -68.38 -43.05 78.21 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.506 0.653 . . . . 0.0 110.189 178.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.12 66.78 1.31 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.172 0.51 . . . . 0.0 110.905 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.621 ' HG3' ' HA2' ' A' ' 13' ' ' GLY . 73.4 mtm -70.35 -25.01 63.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.188 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.78 -31.86 62.98 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.663 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 23.9 mt-30 -87.97 -25.37 23.2 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.059 -0.656 . . . . 0.0 111.091 -172.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -71.46 -35.33 70.84 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.937 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.31 -52.62 62.93 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.114 -178.063 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.03 -36.95 67.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.53 -175.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 15.6 tt0 -68.63 -42.27 78.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.727 0.299 . . . . 0.0 111.201 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.749 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 18.0 mt -84.2 -1.08 54.52 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.822 0.344 . . . . 0.0 110.664 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 63.69 36.59 10.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.304 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.937 ' HB2' ' HD3' ' A' ' 20' ' ' LYS . 1.2 mm? -49.41 119.16 8.87 Favored Pre-proline 0 N--CA 1.471 0.59 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.73 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.564 ' HD2' ' CD2' ' A' ' 47' ' ' LEU . 12.7 Cg_exo -73.93 154.17 47.87 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.416 2.077 . . . . 0.0 109.861 167.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -55.79 -32.9 63.91 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.443 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -66.03 -53.02 43.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.855 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.579 ' CB ' HD23 ' A' ' 47' ' ' LEU . 36.0 t -70.35 -50.68 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.718 -176.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.518 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 8.8 p -59.7 -33.4 51.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.152 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.93 -51.17 58.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.556 177.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.92 -32.58 73.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.064 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.6 tp -48.44 -55.38 11.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.081 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.92 13.39 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.466 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 52.0 t30 -53.86 122.31 9.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 119.521 1.055 . . . . 0.0 111.803 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -71.79 -33.15 68.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.917 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 31.0 m-90 -79.04 145.41 33.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.14 0.495 . . . . 0.0 110.965 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.57 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.65 54.28 2.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.462 -173.516 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.508 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 27.7 t70 -43.52 -42.59 5.03 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.9 t70 63.08 70.44 0.54 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 118.861 0.755 . . . . 0.0 109.853 -175.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.508 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 1.5 p90 -106.3 175.5 5.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.8 -175.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 93.6 t -84.1 125.14 40.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.754 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttp -77.71 96.03 4.77 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.214 0.531 . . . . 0.0 110.226 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -103.42 -39.11 6.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.755 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.408 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 10.2 t70 -69.42 124.85 24.96 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.74 0.781 . . . . 0.0 110.07 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.561 ' HG2' ' HG2' ' A' ' 109' ' ' MET . 2.5 mpt_? -79.89 -28.06 39.92 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.717 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.737 HD11 HD22 ' A' ' 25' ' ' LEU . 7.4 tp -69.61 -19.06 63.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.948 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.57 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -78.37 -60.61 2.3 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.91 -46.78 1.78 Allowed Glycine 0 CA--C 1.534 1.227 0 CA-C-N 114.399 -1.273 . . . . 0.0 114.654 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 74.2 m -66.85 -43.61 83.2 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.522 1.161 . . . . 0.0 110.619 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.5 -22.07 66.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.761 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 48' ' ' ALA . 47.8 mm -61.83 -36.23 72.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-O 120.903 0.382 . . . . 0.0 111.127 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -122.2 76.88 1.34 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.557 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.7 p -125.19 -47.29 1.76 Allowed 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.301 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.9 tt -63.53 -65.51 0.67 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 111.786 -168.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.15 -12.47 59.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.252 0.548 . . . . 0.0 110.016 -174.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.538 ' HA ' HG11 ' A' ' 61' ' ' VAL . 56.3 m -83.9 -33.05 24.83 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.726 176.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 8.1 mmmt -75.35 -23.44 57.2 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.363 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.5 mt -63.79 -66.28 0.56 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.571 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -177.4 123.96 0.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.588 HG23 ' CD2' ' A' ' 76' ' ' PHE . 10.4 p -178.67 34.57 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.99 0.9 . . . . 0.0 110.139 -174.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.716 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 28.1 m -98.82 114.02 35.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.802 0.811 . . . . 0.0 112.227 -170.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.23 -56.31 10.99 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.954 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.565 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 13.6 Cg_endo -97.91 -138.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 123.311 2.674 . . . . 0.0 113.254 -170.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.2 m-20 -72.24 2.39 6.06 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.622 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.19 -75.92 0.3 Allowed Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.8 p-10 -75.17 170.91 15.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.803 -0.699 . . . . 0.0 110.317 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 69.66 29.79 4.11 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.519 0.512 . . . . 0.0 111.621 173.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.716 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 3.5 p80 -73.11 79.89 1.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.392 0.615 . . . . 0.0 110.984 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 21.9 p-80 -85.1 -58.85 2.52 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.651 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.0 -61.49 6.37 Favored Glycine 0 N--CA 1.443 -0.867 0 C-N-CA 121.154 -0.545 . . . . 0.0 113.171 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -54.1 -36.02 62.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -71.55 -37.89 71.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.204 0.525 . . . . 0.0 111.337 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.461 ' NZ ' HG21 ' A' ' 94' ' ' ILE . 92.2 mttt -81.37 -30.45 33.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.002 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.13 -41.64 94.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.144 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.588 ' CD2' HG23 ' A' ' 61' ' ' VAL . 2.5 m-85 -62.57 -36.65 83.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.857 176.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.9 -40.27 75.73 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.639 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.629 ' HB3' ' CB ' ' A' ' 87' ' ' ALA . 1.7 ptt? -76.92 -14.87 59.82 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.645 ' HG3' ' HD2' ' A' ' 80' ' ' HIS . 18.5 ptpt -90.88 -18.61 24.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.126 173.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.645 ' HD2' ' HG3' ' A' ' 79' ' ' LYS . 12.3 p80 -149.77 99.49 2.86 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.683 0.278 . . . . 0.0 111.565 172.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.18 -75.97 0.41 Allowed Glycine 0 C--O 1.234 0.123 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.099 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.606 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -89.22 149.94 22.88 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.297 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.651 ' OD2' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -88.7 167.4 13.36 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.943 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -72.56 -23.31 60.96 Favored 'General case' 0 N--CA 1.421 -1.907 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.716 -166.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.651 ' HB ' ' OD2' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -73.29 -34.35 65.71 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.338 176.672 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.474 ' HA ' HE21 ' A' ' 89' ' ' GLN . 3.3 tpt -77.27 -43.52 33.02 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.111 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.629 ' CB ' ' HB3' ' A' ' 78' ' ' MET . . . -65.24 -41.59 94.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.353 175.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -69.23 -26.25 64.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -175.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.474 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.7 pt20 -82.78 -28.9 29.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.844 175.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -76.93 -46.73 23.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 87' ' ' ALA . 25.4 m -57.69 -35.9 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.892 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.21 -44.51 88.06 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.924 0.392 . . . . 0.0 110.567 -176.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.582 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.2 mp -60.21 -42.66 91.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.455 174.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.506 ' HA ' ' HB ' ' A' ' 114' ' ' VAL . 59.6 mt -55.25 -47.17 78.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.312 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -67.07 -31.45 71.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.429 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 99' ' ' LYS . . . -80.97 -50.67 5.08 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.374 -173.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 13.8 m -73.61 -32.75 64.24 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.171 -0.612 . . . . 0.0 112.21 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 94' ' ' ILE . 8.7 tp10 -57.89 -38.48 75.87 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.434 0.561 . . . . 0.0 110.416 168.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 96' ' ' GLY . 31.8 ttpt -63.48 -40.85 98.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.592 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.8 m -102.11 24.41 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.305 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.69 152.92 49.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 55.7 Cg_endo -69.87 162.19 43.08 Favored 'Trans proline' 0 CA--C 1.529 0.249 0 C-N-CA 122.578 2.186 . . . . 0.0 112.275 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 17.0 Cg_exo -69.2 59.01 1.33 Allowed 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.402 2.735 . . . . 0.0 112.587 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -103.93 113.28 26.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.504 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -79.0 16.31 0.94 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.811 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.1 t70 -90.85 112.18 23.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.093 0.473 . . . . 0.0 110.581 -176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.63 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.47 -54.25 3.17 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.557 ' O ' HD13 ' A' ' 112' ' ' ILE . 68.4 m -83.33 -21.91 33.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.371 0.987 . . . . 0.0 112.187 -176.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.811 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 5.7 mmm -63.33 -44.54 94.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.161 0.505 . . . . 0.0 110.57 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.634 ' HA ' ' OD2' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -66.17 -49.26 67.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.058 -177.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.448 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.64 -13.83 4.53 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.98 175.183 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.2 mp -91.06 -41.56 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 O-C-N 121.933 -0.479 . . . . 0.0 110.03 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.634 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 3.2 p30 -63.08 -34.15 76.97 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.494 177.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 18.8 m -80.09 -36.31 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.49 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.53 -50.5 72.42 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 121.701 0.763 . . . . 0.0 111.339 176.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.756 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.3 ptt? -68.72 -17.75 64.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.784 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 25.8 t -71.92 -30.55 65.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.601 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.582 ' HB2' HG21 ' A' ' 93' ' ' ILE . 85.4 t80 -72.04 -44.91 62.6 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.776 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.429 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.68 -29.25 66.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 118.139 -1.424 . . . . 0.0 111.276 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.756 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.61 -56.21 19.15 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.756 170.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.53 -51.04 71.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.409 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -32.79 41.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 118.22 0.464 . . . . 0.0 111.287 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -71.98 -31.9 66.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.455 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -79.05 -36.19 41.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.332 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.624 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 2.6 Cg_exo . . . . . 0 CA--C 1.534 0.494 0 N-CA-C 114.921 1.085 . . . . 0.0 114.921 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -49.06 -70.57 0.09 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.607 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.9 tp -86.31 -9.47 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 121.124 0.488 . . . . 0.0 111.467 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.624 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 85.3 mtp -77.71 -30.6 51.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.959 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -84.7 94.37 8.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.219 0.533 . . . . 0.0 109.838 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -71.94 115.6 11.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.182 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 8' ' ' LEU . 5.8 mp -58.48 -37.73 76.14 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.342 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.548 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 6.1 p -65.08 -28.74 69.67 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.96 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.98 -26.51 56.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.894 175.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 8' ' ' LEU . 0.8 OUTLIER -66.82 -45.66 77.59 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.107 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.548 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 67.9 m-85 -55.23 -84.37 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.381 171.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.02 36.79 15.33 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.688 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -66.34 -37.62 85.75 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.812 0.339 . . . . 0.0 111.012 -177.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.14 92.23 2.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.071 0.462 . . . . 0.0 109.85 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttp -71.32 -33.08 69.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.0 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.0 -29.3 65.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.064 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -88.52 -21.23 24.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.876 -172.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.9 t -74.85 -36.17 62.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -63.49 -45.56 90.17 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.384 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.84 -47.63 58.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.87 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.9 tp10 -67.96 -40.69 83.15 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.45 ' HB2' HD22 ' A' ' 25' ' ' LEU . 2.2 mm? -77.81 -21.52 51.43 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.468 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 61.67 48.16 5.83 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.843 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.875 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -61.29 128.34 89.52 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.359 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.4 Cg_exo -66.46 149.85 84.42 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.812 1.675 . . . . 0.0 109.694 170.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -61.06 -31.65 71.3 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 121.152 -0.219 . . . . 0.0 110.975 -175.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.4 m -66.46 -46.39 76.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.875 0.369 . . . . 0.0 110.801 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 47' ' ' LEU . 38.3 t -71.38 -52.73 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.626 -176.212 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 5.0 p -60.2 -34.97 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.871 -175.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.36 -51.52 59.88 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.94 0.4 . . . . 0.0 111.267 177.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.68 -37.46 76.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.578 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.542 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 1.6 pp -59.81 -30.64 69.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.536 177.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -62.86 9.8 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 174.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -56.03 110.18 0.7 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 120.474 1.488 . . . . 0.0 111.367 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -76.48 -14.96 60.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.059 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -88.2 157.95 18.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -87.07 53.6 2.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.779 0.8 . . . . 0.0 109.959 175.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.579 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 10.6 t70 -42.78 -45.5 4.84 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.818 177.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 63.04 70.47 0.55 Allowed 'General case' 0 C--N 1.347 0.481 0 CA-C-O 121.639 0.733 . . . . 0.0 109.85 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 14.9 p90 -109.76 164.05 12.93 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.305 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 38.2 t -84.17 113.91 23.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.417 ' HB3' HG21 ' A' ' 112' ' ' ILE . 38.6 ttm -70.99 104.32 2.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.17 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -108.22 -18.43 13.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.392 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.15 139.68 30.39 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.94 0.876 . . . . 0.0 111.382 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.556 ' HA ' ' HG2' ' A' ' 109' ' ' MET . 6.7 mpt_? -70.72 -32.65 69.91 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.898 -1.501 . . . . 0.0 110.608 -171.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.643 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.3 mm? -73.62 -15.07 61.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.968 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.64 -61.03 2.09 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.618 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.11 -48.01 3.48 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.079 -0.964 . . . . 0.0 114.586 168.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 m -66.15 -42.66 88.72 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.495 1.148 . . . . 0.0 111.56 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.94 -23.14 67.25 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.2 mm -55.79 -38.35 51.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.053 0.454 . . . . 0.0 110.329 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -131.27 81.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.214 1.007 . . . . 0.0 110.142 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.5 t -114.58 -47.19 2.92 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.706 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.468 ' O ' HD23 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.33 -68.02 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.016 0.436 . . . . 0.0 111.195 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.55 -10.46 59.45 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.087 0.47 . . . . 0.0 110.612 -172.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.956 HG23 HG11 ' A' ' 61' ' ' VAL . 51.7 m -78.8 -35.8 43.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 174.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . 3.1 mtpt -80.64 -17.31 51.65 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.514 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.468 HD23 ' O ' ' A' ' 55' ' ' LEU . 3.8 mm? -63.93 -60.16 3.61 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.127 170.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -176.02 116.86 0.13 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.603 0.24 . . . . 0.0 110.848 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.956 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -155.0 31.37 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.515 0.674 . . . . 0.0 110.501 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.668 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.4 m -107.84 121.65 61.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 O-C-N 121.761 -0.587 . . . . 0.0 111.901 -174.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -76.2 -57.49 1.39 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.218 174.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.76 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 65.9 Cg_endo -104.18 -138.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.768 2.979 . . . . 0.0 113.596 -167.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.8 m-20 -72.2 12.01 0.5 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.895 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.56 -74.59 0.39 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 7.5 p30 -70.28 153.12 43.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.249 -0.475 . . . . 0.0 110.386 176.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.58 36.69 2.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.384 0.611 . . . . 0.0 110.645 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.76 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 8.5 p80 -72.37 79.88 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.535 0.683 . . . . 0.0 111.045 175.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -86.94 -60.38 2.0 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.085 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.78 -62.26 6.3 Favored Glycine 0 CA--C 1.507 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 113.115 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -59.14 -23.54 62.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.09 64.95 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.272 0.558 . . . . 0.0 110.769 178.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.747 ' HE2' HG12 ' A' ' 91' ' ' VAL . 32.0 mmmt -80.3 -32.5 38.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.823 177.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.48 -39.9 94.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.685 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -63.49 -42.81 98.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.628 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.04 -37.78 72.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.611 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.1 mtm -69.92 -32.13 70.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.601 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HD2' ' HA ' ' A' ' 79' ' ' LYS . 16.9 tptm -93.25 -10.32 36.01 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.822 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.512 ' HB3' HD22 ' A' ' 8' ' ' LEU . 75.7 m-70 -141.96 89.74 2.21 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 122.076 -0.39 . . . . 0.0 110.85 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' A' ' 8' ' ' LEU . . . 127.35 -68.17 0.54 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.793 174.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.607 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -106.34 140.85 38.62 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.851 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.37 159.65 29.35 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.286 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -61.6 -49.83 75.03 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.744 -164.765 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 7.0 t -60.14 -28.7 68.11 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.959 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.7 tpt -79.86 -46.24 17.21 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.48 0.657 . . . . 0.0 109.735 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.65 -35.78 70.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.805 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.12 -25.17 60.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.594 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.0 mm-40 -75.65 -23.54 56.3 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 172.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.65 ' O ' HG13 ' A' ' 94' ' ' ILE . 36.3 tp -84.98 -41.98 15.35 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.255 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.747 HG12 ' HE2' ' A' ' 74' ' ' LYS . 35.1 m -57.6 -35.81 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -66.22 -44.12 84.73 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.232 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.821 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.4 mp -62.11 -44.18 98.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.606 173.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.65 HG13 ' O ' ' A' ' 90' ' ' LEU . 39.2 mt -51.89 -47.06 41.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-O 120.716 0.293 . . . . 0.0 110.526 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.53 -36.6 73.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.923 0.392 . . . . 0.0 110.641 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.59 -42.32 7.87 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 119.979 -1.105 . . . . 0.0 112.004 -173.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.629 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.2 m -73.23 -41.44 63.73 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HG2' HG11 ' A' ' 114' ' ' VAL . 24.1 mm-40 -56.68 -38.73 72.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.45 171.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -69.68 -42.73 73.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.755 0.312 . . . . 0.0 111.661 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.0 m -96.86 8.01 45.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.37 149.83 94.11 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.04 164.85 4.48 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.111 2.541 . . . . 0.0 112.265 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 38.63 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.437 2.758 . . . . 0.0 113.212 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.45 104.98 16.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.718 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.83 87.05 4.71 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.4 t0 -112.05 104.23 12.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.279 -174.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -35.69 -76.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 124.595 1.184 . . . . 0.0 113.787 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.1 t -94.99 -15.59 23.41 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.556 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 1.9 mmm -86.02 -22.99 26.98 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -168.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.716 ' HD3' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.57 -38.6 81.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 122.069 0.938 . . . . 0.0 110.076 -175.367 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.919 HG22 HD12 ' A' ' 112' ' ' ILE . 0.6 OUTLIER -56.27 -16.86 6.1 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.101 -1.409 . . . . 0.0 112.291 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.919 HD12 HG22 ' A' ' 111' ' ' THR . 1.8 mp -91.17 -36.74 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -58.72 -37.1 75.42 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.199 176.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.616 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 4.8 m -80.71 -32.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.656 0.741 . . . . 0.0 109.971 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.57 -48.93 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.746 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.0 ptt? -69.18 -13.65 62.53 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.366 177.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.93 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 52.5 t -73.64 -31.75 63.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.758 173.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.821 ' HB2' HG21 ' A' ' 93' ' ' ILE . 74.2 t80 -74.17 -47.1 38.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.173 177.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.467 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.45 -23.99 63.74 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 118.492 -1.283 . . . . 0.0 110.163 -178.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.93 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 25.0 ttpt -56.73 -54.09 50.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.017 0.437 . . . . 0.0 110.314 166.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -58.73 -48.81 79.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.539 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.467 HG22 ' HA ' ' A' ' 119' ' ' LYS . 10.7 tt -58.44 -30.13 40.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 CA-C-N 118.361 0.528 . . . . 0.0 110.762 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -71.28 -32.52 68.77 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.82 -33.72 74.3 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.433 0.635 . . . . 0.0 109.783 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.516 175.665 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.577 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 36.9 Cg_exo . . . . . 0 N--CA 1.471 0.204 0 N-CA-C 112.761 0.254 . . . . 0.0 112.761 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -50.79 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.851 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.2 tt -83.16 -9.85 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.345 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.577 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.1 ttt -66.32 -28.66 68.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.244 0.545 . . . . 0.0 109.887 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -83.6 100.24 10.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.754 172.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.8 137.8 58.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.524 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.2 mt -54.18 -34.53 60.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.201 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.6 p -62.16 -40.75 97.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.277 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -77.12 -30.45 55.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -68.21 -55.34 12.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -57.56 -82.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 170.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.19 36.35 35.93 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.804 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -69.37 -49.62 53.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.198 0.499 . . . . 0.0 110.383 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -153.8 105.39 2.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.488 178.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 54.7 ttp -75.47 -21.78 57.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.254 0.55 . . . . 0.0 110.194 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -63.03 -23.91 67.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.716 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.683 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 21.0 pt20 -84.56 -25.69 28.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.335 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.0 m -75.25 -35.45 61.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.513 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.09 -49.5 74.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.209 -178.096 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -70.62 -43.09 69.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.424 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.683 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.5 tm-20 -62.0 -44.29 97.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.966 -175.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.448 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 15.2 mt -81.98 -13.65 57.14 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.637 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.0 m 57.64 38.36 27.69 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.091 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.605 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 19.2 mt -51.01 120.94 14.66 Favored Pre-proline 0 N--CA 1.465 0.325 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.093 -174.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.3 Cg_exo -69.05 154.46 70.53 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.165 1.91 . . . . 0.0 111.036 174.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.637 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.3 p-10 -65.63 -27.34 68.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.678 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -64.64 -40.52 95.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 109.566 174.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.3 t -72.85 -50.1 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.234 -177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.8 m -54.98 -30.75 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 120.876 0.369 . . . . 0.0 110.21 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.21 -51.53 63.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.554 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -70.62 -39.22 73.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.453 0.644 . . . . 0.0 109.748 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 2.7 tm? -51.25 -54.35 26.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.576 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.24 9.66 0.07 Allowed 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -66.67 104.27 1.26 Allowed 'General case' 0 C--N 1.345 0.404 0 CA-C-N 120.332 1.423 . . . . 0.0 109.483 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -86.49 -20.16 28.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.512 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -90.27 142.32 27.84 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.439 0.638 . . . . 0.0 110.894 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.665 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -80.64 65.73 5.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.092 -171.858 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -62.39 -27.4 69.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.656 170.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.5 t70 63.09 70.66 0.54 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.593 0.711 . . . . 0.0 109.563 -172.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.4 p90 -95.63 163.15 13.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.082 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.8 t -87.97 121.64 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.552 ' O ' HG21 ' A' ' 112' ' ' ILE . 43.4 tpp -76.45 104.68 7.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.474 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 p -110.13 -4.79 15.59 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.76 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -96.4 131.45 42.94 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 110.443 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.477 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 8.8 mpt_? -73.02 -23.9 60.67 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.87 -171.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.605 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.8 mm? -78.16 -18.12 55.95 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.055 0.455 . . . . 0.0 109.928 -177.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -85.16 -55.81 3.86 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -175.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.44 -48.32 2.94 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.939 165.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.7 m -64.12 -42.02 97.01 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.143 0.971 . . . . 0.0 111.667 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.539 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.1 mm -63.77 -29.74 48.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.963 0.411 . . . . 0.0 111.34 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -135.8 44.49 2.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.933 0.397 . . . . 0.0 111.362 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.552 ' SG ' HD12 ' A' ' 55' ' ' LEU . 24.6 p -94.27 -36.15 12.12 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.552 HD12 ' SG ' ' A' ' 54' ' ' CYS . 8.6 mp -56.41 -69.67 0.14 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -170.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.477 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.75 -8.8 59.73 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.061 0.458 . . . . 0.0 110.777 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.609 ' HA ' HG11 ' A' ' 61' ' ' VAL . 55.8 m -80.47 -35.16 35.23 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.297 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HE2' ' HG3' ' A' ' 22' ' ' GLU . 16.9 mmmt -77.64 -21.84 51.63 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.4 173.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.9 mt -65.05 -65.84 0.62 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.814 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.16 119.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.609 HG11 ' HA ' ' A' ' 57' ' ' THR . 10.6 p -178.4 34.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.613 0.72 . . . . 0.0 111.13 -177.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.68 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.7 m -102.24 118.78 49.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.953 -1.092 . . . . 0.0 111.256 -173.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.16 -56.01 14.33 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.265 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.611 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 8.7 Cg_endo -95.01 -139.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.009 2.473 . . . . 0.0 112.854 -171.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.45 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 3.8 m-20 -76.27 11.18 1.63 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.587 -176.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.8 -75.41 0.4 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.523 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.3 p30 -75.33 159.3 31.62 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.03 -0.585 . . . . 0.0 111.158 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 68.95 43.24 1.18 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.255 0.55 . . . . 0.0 111.967 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.68 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 6.7 p80 -83.34 76.0 9.94 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.476 0.655 . . . . 0.0 110.693 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -86.86 -61.93 1.62 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.814 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.15 -52.8 51.2 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.619 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -56.94 -34.68 68.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.286 . . . . 0.0 111.579 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.12 -36.15 74.6 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.184 0.516 . . . . 0.0 111.224 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 74' ' ' LYS . 21.1 mmmt -79.82 -35.18 38.78 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 33.3 t70 -64.18 -35.44 80.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.648 173.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.508 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 52.0 t80 -62.26 -35.27 78.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.485 176.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.21 72.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.856 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -68.2 -39.05 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.639 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 76' ' ' PHE . 34.3 pttt -93.29 -5.95 48.58 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.227 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.45 ' ND1' ' HG3' ' A' ' 79' ' ' LYS . 63.9 m80 -136.06 88.9 2.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.629 0.252 . . . . 0.0 110.75 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.22 -75.09 0.36 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.802 172.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -99.56 132.59 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.896 0.379 . . . . 0.0 111.331 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.481 ' OD2' HG22 ' A' ' 85' ' ' THR . 6.5 p-10 -79.21 172.36 13.91 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.62 -45.68 77.48 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -164.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.743 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 11.3 t -53.66 -40.69 66.1 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 58.9 mtm -82.24 -38.22 24.81 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.111 0.482 . . . . 0.0 109.701 -174.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.67 -37.58 76.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.165 172.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.76 -24.93 59.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.997 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.743 ' HG2' ' O ' ' A' ' 85' ' ' THR . 66.0 mm-40 -77.88 -23.49 48.77 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 64.1 tp -88.3 -48.26 7.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.293 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 88' ' ' GLN . 17.1 m -57.22 -38.13 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -172.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -68.14 -43.38 78.45 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.389 0.614 . . . . 0.0 110.363 -175.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.702 HG23 ' HB2' ' A' ' 117' ' ' CYS . 1.7 mp -61.8 -43.01 96.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.713 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.6 mt -55.64 -47.05 79.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.223 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -65.67 -34.71 78.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.505 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.71 -60.19 2.23 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.389 -169.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.792 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 8.8 p -74.01 -27.31 60.9 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.041 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.1 tm-20 -65.27 -38.25 89.71 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 118.576 -1.25 . . . . 0.0 109.783 171.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -64.74 -43.29 93.82 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.878 176.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -103.54 26.12 8.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.912 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.62 155.61 92.57 Favored Pre-proline 0 C--O 1.235 0.328 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' A' ' 104' ' ' ASN . 53.3 Cg_exo -53.69 164.99 1.95 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.003 2.468 . . . . 0.0 112.482 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.79 31.24 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.499 2.799 . . . . 0.0 113.169 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 102' ' ' PRO . 4.6 m-20 -122.17 94.79 4.41 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.578 176.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.38 92.88 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.2 t70 -91.01 104.59 17.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.324 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.42 ' O ' ' HD2' ' A' ' 110' ' ' LYS . 18.1 tttp -34.73 -74.35 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -167.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 27.7 t -90.82 -9.72 45.41 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.846 -0.533 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.415 ' HB2' ' OD1' ' A' ' 106' ' ' ASP . 3.0 mmm -87.74 -22.04 24.82 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -168.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.582 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -55.12 -45.85 75.57 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.703 0.763 . . . . 0.0 110.82 -173.196 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.646 HG22 HD12 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -53.97 -14.91 1.15 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.114 -1.403 . . . . 0.0 113.112 177.544 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.646 HD12 HG22 ' A' ' 111' ' ' THR . 1.7 mp -92.02 -39.06 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 -38.48 77.51 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 175.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.849 ' HA ' ' SG ' ' A' ' 117' ' ' CYS . 3.6 m -82.5 -34.07 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 CA-C-O 122.2 1.0 . . . . 0.0 110.347 -176.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.74 -43.38 90.22 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.72 173.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.588 ' HB2' ' HE2' ' A' ' 119' ' ' LYS . 22.5 ptt? -68.36 -20.01 64.68 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.301 -0.96 . . . . 0.0 112.111 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.864 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 1.4 m -66.85 -30.5 70.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 118.844 0.747 . . . . 0.0 109.228 170.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.05 -46.36 57.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.588 ' HE2' ' HB2' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.58 -21.97 62.62 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.57 177.567 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.864 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.22 -48.87 77.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 169.245 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.4 -52.12 66.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.09 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -56.95 -35.68 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 117.726 0.239 . . . . 0.0 110.906 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -72.72 -17.57 61.6 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.07 -35.02 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 122.022 -0.424 . . . . 0.0 110.576 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 C--N 1.326 -0.447 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.239 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 113.243 0.439 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -51.62 -74.17 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.726 HD11 ' HB2' ' A' ' 82' ' ' ALA . 27.3 mm -91.03 -16.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.005 0.431 . . . . 0.0 111.89 177.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.5 tpt -69.73 -34.81 74.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -100.27 105.32 16.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 9' ' ' SER . 6.1 t-20 -61.55 112.57 2.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.868 -174.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.598 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -64.57 -23.22 67.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.433 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.435 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m -63.65 -40.23 96.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.057 0.456 . . . . 0.0 109.84 175.233 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -75.95 -30.14 58.55 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.64 -51.97 43.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -56.44 -79.48 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.642 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.81 39.85 40.38 Favored Glycine 0 C--N 1.346 1.137 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.338 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -62.79 -42.45 99.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.863 0.332 . . . . 0.0 111.665 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.764 ' H ' HD21 ' A' ' 55' ' ' LEU . . . -144.55 105.01 4.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.059 0.456 . . . . 0.0 111.403 -177.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttm -75.45 -42.11 54.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.263 0.554 . . . . 0.0 110.76 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -63.36 -22.66 67.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.644 -175.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -88.0 -25.37 23.17 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.92 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' HD23 ' A' ' 23' ' ' LEU . 14.7 m -71.91 -33.85 68.63 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 170.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 25' ' ' LEU . 48.8 tptt -58.88 -55.28 37.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.911 175.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.1 -44.45 65.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.039 -174.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 19.6 tp10 -64.59 -39.27 93.43 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.728 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 4.4 mm? -82.43 -19.71 38.44 Favored 'General case' 0 CA--C 1.514 -0.435 0 O-C-N 122.213 -0.305 . . . . 0.0 110.479 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m 61.63 46.76 6.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -168.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 23' ' ' LEU . 20.5 mt -62.72 121.59 68.91 Favored Pre-proline 0 N--CA 1.453 -0.32 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.067 -170.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.615 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 24.0 Cg_exo -61.54 149.67 88.72 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.115 1.877 . . . . 0.0 110.427 176.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -59.97 -35.16 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.744 0.306 . . . . 0.0 110.973 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.3 m -69.16 -39.4 78.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.507 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 80.7 t -74.23 -52.97 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.719 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.9 p -57.53 -37.02 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.175 0.512 . . . . 0.0 110.273 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.33 61.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.221 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -71.78 -23.46 61.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.054 0.455 . . . . 0.0 110.716 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.63 -50.75 69.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.462 ' CE2' HG22 ' A' ' 30' ' ' VAL . 10.0 m-85 -77.28 10.61 2.36 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -57.54 130.49 46.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -72.46 -37.18 68.58 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -171.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 45.1 p90 -92.34 131.69 37.33 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.415 178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.439 ' H ' ' HG2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -89.38 73.31 7.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.546 0.689 . . . . 0.0 110.57 -178.129 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.491 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 36.3 t70 -42.7 -33.32 0.71 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.7 t0 67.2 51.27 0.93 Allowed 'General case' 0 C--N 1.348 0.531 0 CA-C-O 122.186 0.993 . . . . 0.0 109.715 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.491 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -91.62 178.03 6.04 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.159 174.431 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 44' ' ' THR . 25.7 t -83.33 117.93 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 29.4 ttp -67.65 92.85 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.185 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 42' ' ' VAL . 66.5 p -95.91 -8.78 33.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.527 -174.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 10.7 t70 -97.08 134.58 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.267 0.556 . . . . 0.0 111.503 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.613 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 6.2 mpt_? -76.31 -21.1 56.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.119 -174.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.615 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 3.9 mm? -79.64 -15.23 57.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.212 -176.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.41 -61.87 1.73 Allowed 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -176.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.69 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -42.45 -48.01 5.75 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.402 168.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 m -67.27 -44.46 79.26 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.581 1.191 . . . . 0.0 111.823 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.42 36.95 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.015 -0.428 . . . . 0.0 111.701 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.92 -29.37 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.424 ' O ' ' HB ' ' A' ' 57' ' ' THR . 23.3 t-20 -146.25 70.81 1.23 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.406 0.622 . . . . 0.0 110.707 175.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 58' ' ' LYS . 8.9 p -98.36 -41.77 7.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.901 174.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.764 HD21 ' H ' ' A' ' 15' ' ' ALA . 1.7 tm? -55.87 -66.0 0.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.057 0.456 . . . . 0.0 111.068 -176.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -82.75 -16.38 48.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.584 -169.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.43 HG23 ' CG2' ' A' ' 61' ' ' VAL . 23.7 m -84.16 -39.62 19.19 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.788 174.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.688 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 22.8 mmtt -81.62 -2.55 50.6 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.063 -0.398 . . . . 0.0 111.567 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 9.8 mt -64.99 -67.65 0.42 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.505 166.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -178.9 101.33 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.114 0.259 . . . . 0.0 110.978 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.43 ' CG2' HG23 ' A' ' 57' ' ' THR . 30.4 m -148.95 50.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-O 121.35 0.595 . . . . 0.0 111.169 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.644 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 5.9 m -99.9 120.58 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.85 -0.531 . . . . 0.0 110.915 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 69' ' ' HIS . 1.8 t70 -75.2 -57.73 1.66 Allowed Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.639 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 19.4 Cg_endo -98.68 -139.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.237 2.624 . . . . 0.0 113.058 -168.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 4.0 m-20 -72.63 10.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.244 -176.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.81 -70.02 0.52 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.639 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.9 p30 -75.09 154.43 37.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.86 -0.67 . . . . 0.0 111.468 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 68.99 33.78 3.34 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.695 172.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.1 p80 -79.68 69.87 6.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.914 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 2.5 p-80 -85.67 -33.24 21.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.249 177.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.41 -62.84 4.75 Favored Glycine 0 CA--C 1.511 -0.216 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.382 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' A' ' 63' ' ' ASP . 11.1 t-20 -57.52 -30.49 65.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.61 -0.295 . . . . 0.0 111.532 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.73 -36.39 65.18 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.178 0.514 . . . . 0.0 111.372 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 24.4 mmmt -80.37 -35.03 35.96 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.18 -38.8 90.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.619 ' CZ ' ' HB1' ' A' ' 56' ' ' ALA . 48.8 t80 -56.11 -43.42 78.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.923 175.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.55 -34.02 71.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.969 0.414 . . . . 0.0 111.212 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.0 mtt -74.6 -34.86 62.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.669 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.915 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 9.5 mmpt? -91.37 -10.13 42.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.551 -0.459 . . . . 0.0 111.138 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -143.5 93.87 2.53 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 128.83 -75.5 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.543 174.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.726 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -98.36 151.41 20.56 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.537 0.208 . . . . 0.0 110.743 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.585 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.4 p-10 -91.84 172.95 8.12 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -58.04 -38.08 75.6 Favored 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -170.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 8.0 t -62.44 -35.95 80.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.526 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.438 ' O ' HD13 ' A' ' 90' ' ' LEU . 59.1 mtp -83.05 -39.12 21.63 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -176.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.63 -34.41 72.76 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.59 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.791 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.36 -23.61 54.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.484 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.8 mm-40 -77.81 -25.04 48.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.8 mp -85.37 -46.26 11.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.409 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.791 HG22 ' HA ' ' A' ' 88' ' ' GLN . 6.3 m -58.62 -32.33 45.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.38 -44.46 75.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 0.0 110.184 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.721 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.7 mp -68.76 -41.97 82.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.274 177.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 65.3 mt -56.98 -49.26 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 0.0 110.026 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -72.52 -36.36 68.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.276 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.44 -45.96 5.97 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.051 -172.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.571 ' SG ' HG23 ' A' ' 93' ' ' ILE . 83.5 m -70.74 -39.86 73.06 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.878 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.6 tm-20 -63.34 -38.23 90.36 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.222 0.465 . . . . 0.0 110.449 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -68.22 -36.04 78.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 110.939 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.3 m -96.69 7.79 45.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 111.272 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.19 144.6 84.82 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.1 -176.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 35.4 Cg_exo -61.14 146.12 97.95 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.347 2.032 . . . . 0.0 110.124 174.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 37.9 Cg_exo -57.07 91.14 0.05 OUTLIER 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.967 2.445 . . . . 0.0 113.256 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -125.97 93.47 3.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 175.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -81.3 63.45 5.63 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 0.0 110.927 -175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.778 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.3 t70 -124.18 112.36 16.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.213 172.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -34.09 -55.0 0.5 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.7 t -88.19 -30.55 19.66 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.032 0.833 . . . . 0.0 112.294 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.778 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 73.2 mmm -65.28 -36.25 83.5 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 111' ' ' THR . 5.6 ptpt -57.79 -48.39 79.83 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.818 0.818 . . . . 0.0 110.346 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.622 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -57.46 -10.66 1.52 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.602 174.682 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.69 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.1 mp -89.84 -41.36 13.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 4.4 m-20 -59.66 -35.49 74.53 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.362 174.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.581 HG22 ' HA ' ' A' ' 111' ' ' THR . 7.1 m -80.76 -35.49 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.046 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.41 -51.57 68.92 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.337 0.589 . . . . 0.0 111.472 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.701 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.97 -25.17 64.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.251 179.538 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.5 t -68.57 -27.03 65.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.745 175.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.721 ' HB2' HG21 ' A' ' 93' ' ' ILE . 66.3 t80 -74.36 -44.31 52.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.285 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.567 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 1.2 pttp -70.49 -29.72 66.32 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.174 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.701 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.34 -56.18 23.01 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.958 0.409 . . . . 0.0 110.322 169.649 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -61.95 -42.28 98.93 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 175.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.1 -33.67 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 118.488 0.586 . . . . 0.0 111.078 175.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -71.59 -32.22 67.8 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.244 -0.285 . . . . 0.0 111.659 174.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.2 tttt -68.56 -35.84 77.95 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.317 0.58 . . . . 0.0 110.116 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.431 173.149 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo . . . . . 0 C--O 1.23 0.113 0 CA-C-O 121.061 0.359 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.46 -65.98 0.47 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.289 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 4' ' ' ILE . 9.2 tp -72.46 -15.2 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-O 121.126 0.489 . . . . 0.0 111.188 178.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.2 ttt -71.22 -24.94 62.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.91 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -100.33 94.08 6.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.908 174.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -64.12 138.93 58.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.278 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.7 -43.07 84.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.755 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.4 m -62.3 -36.56 82.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.98 -36.88 62.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.011 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.93 -55.82 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.956 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -48.97 -72.41 0.05 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.24 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.36 29.61 46.86 Favored Glycine 0 C--N 1.347 1.141 0 C-N-CA 121.039 -0.6 . . . . 0.0 113.772 -177.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.449 ' H ' HD11 ' A' ' 55' ' ' LEU . 64.8 tttm -85.89 -37.26 19.32 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.14 0.47 . . . . 0.0 110.718 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.589 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.38 56.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.088 0.471 . . . . 0.0 111.314 -177.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.1 ttm -72.38 -38.48 68.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.155 0.502 . . . . 0.0 110.12 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.72 -34.43 74.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.905 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.42 -25.35 20.41 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.53 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 12.3 p -74.95 -33.0 61.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.824 ' HA ' HD22 ' A' ' 25' ' ' LEU . 9.9 tptm -57.11 -50.86 71.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.611 172.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -70.3 -42.65 71.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.44 -36.04 82.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.538 0.209 . . . . 0.0 111.339 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 50' ' ' CYS . 11.3 mt -81.03 -3.75 52.86 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.753 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.1 t 65.45 27.83 11.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.811 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.824 HD22 ' HA ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -55.01 119.86 25.34 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.012 176.506 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -75.01 156.86 42.98 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.774 2.316 . . . . 0.0 111.435 174.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.67 ' HA ' HG22 ' A' ' 30' ' ' VAL . 12.6 p-10 -66.73 -22.59 66.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.17 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 p -68.48 -39.76 81.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.0 110.761 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.35 -50.87 42.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.379 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 27' ' ' ASP . 17.3 m -58.9 -33.6 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.393 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -50.45 67.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.499 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.43 -37.14 86.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.313 0.577 . . . . 0.0 110.01 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mt -57.91 -54.83 42.53 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.056 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -74.88 8.99 2.09 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -176.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -63.24 130.96 46.77 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.349 0.522 . . . . 0.0 110.771 -178.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -74.47 -31.68 62.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.142 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 -81.23 118.0 22.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.778 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.518 ' HD3' ' O ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -81.44 72.95 8.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.351 0.596 . . . . 0.0 111.754 -177.207 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.531 ' HB3' ' CD2' ' A' ' 41' ' ' TYR . 18.7 t70 -44.94 -44.64 9.94 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 173.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.51 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 20.6 m-20 75.01 70.9 0.09 Allowed 'General case' 0 C--N 1.35 0.607 0 CA-C-O 121.522 0.677 . . . . 0.0 110.489 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.531 ' CD2' ' HB3' ' A' ' 39' ' ' ASP . 9.1 p90 -117.73 176.68 5.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.455 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 44' ' ' THR . 6.2 t -92.16 121.06 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.444 ' O ' HG21 ' A' ' 112' ' ' ILE . 41.6 ttm -62.25 100.93 0.19 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.519 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 42' ' ' VAL . 67.9 p -99.32 -23.64 15.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -83.82 134.21 34.72 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.5 0.667 . . . . 0.0 111.484 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.795 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 9.5 mpt_? -74.88 -21.87 58.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.465 -175.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' A' ' 25' ' ' LEU . 2.7 mm? -79.5 -13.04 59.83 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.455 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -61.69 1.89 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -41.07 -48.48 4.34 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 114.901 -1.045 . . . . 0.0 114.293 169.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.604 ' HB3' HD13 ' A' ' 23' ' ' LEU . 15.4 m -68.75 -38.86 80.42 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.49 1.145 . . . . 0.0 111.947 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.31 -23.97 67.49 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 48' ' ' ALA . 70.1 mt -61.96 -37.34 78.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 121.264 0.554 . . . . 0.0 110.622 177.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -132.88 85.47 2.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.803 0.811 . . . . 0.0 110.076 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 24.4 p -119.01 -46.34 2.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.504 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.589 HD11 ' H ' ' A' ' 15' ' ' ALA . 1.5 tt -58.76 -67.07 0.4 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.041 0.448 . . . . 0.0 111.382 -171.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.565 ' HA ' HD12 ' A' ' 59' ' ' LEU . . . -82.04 -14.72 55.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 110.889 -173.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 HG11 ' A' ' 61' ' ' VAL . 1.4 m -83.04 -35.39 25.8 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.527 ' HB3' ' NZ ' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.56 -16.31 49.02 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.199 -0.601 . . . . 0.0 110.069 174.373 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 56' ' ' ALA . 24.9 mt -64.63 -64.99 0.74 Allowed 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 121.164 -0.215 . . . . 0.0 111.206 172.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -174.61 126.2 0.31 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 -177.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.486 HG11 HG23 ' A' ' 57' ' ' THR . 14.6 p 179.89 38.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 122.348 1.07 . . . . 0.0 109.193 -173.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.693 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 25.2 m -105.17 118.56 52.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.198 -172.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -69.37 -56.01 8.96 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.534 175.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.3 Cg_endo -98.28 -142.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 123.537 2.825 . . . . 0.0 113.524 -172.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -72.13 -2.98 20.6 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.866 -174.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.58 -66.22 0.46 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -174.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 7.4 p30 -71.37 153.73 42.1 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.683 -0.759 . . . . 0.0 110.842 178.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 68.47 32.92 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.567 169.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.693 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.7 p80 -74.61 69.18 1.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.864 0.84 . . . . 0.0 110.841 175.091 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 64.2 t60 -86.95 -60.79 1.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.858 -176.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.52 -53.45 45.85 Favored Glycine 0 N--CA 1.461 0.365 0 C-N-CA 121.223 -0.513 . . . . 0.0 113.096 -175.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -56.05 -34.05 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.633 0.254 . . . . 0.0 111.484 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.479 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -74.61 -33.95 62.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.146 0.498 . . . . 0.0 110.744 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 78' ' ' MET . 23.2 mmmt -79.04 -35.32 42.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.35 -40.2 95.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.004 174.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -59.7 -36.74 77.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.531 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -36.25 75.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.901 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 50.8 mtt -67.78 -33.35 74.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.958 0.409 . . . . 0.0 110.782 -177.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -91.27 -10.54 41.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.026 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -145.72 94.4 2.49 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.541 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.4 -60.92 0.41 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.065 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.3 147.28 26.14 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.133 -0.534 . . . . 0.0 110.474 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 86' ' ' MET . 3.6 m-20 -75.72 146.92 39.74 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 173.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.838 ' HG3' HE21 ' A' ' 88' ' ' GLN . 0.2 OUTLIER -67.53 -47.29 70.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.302 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.15 -39.67 44.17 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.87 169.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.574 ' HB3' ' HB2' ' A' ' 83' ' ' ASP . 0.8 OUTLIER -82.82 -37.88 23.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -173.47 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.551 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -60.79 -41.03 94.8 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.993 174.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.838 HE21 ' HG3' ' A' ' 84' ' ' GLU . 2.6 mp0 -71.29 -27.21 63.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.653 -173.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -84.77 -22.07 29.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.742 173.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.7 tt -86.12 -42.53 13.81 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.06 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.478 HG13 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -58.76 -32.98 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 122.944 0.498 . . . . 0.0 111.948 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.73 -42.29 97.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.015 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -62.59 -41.49 92.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.012 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.545 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 34.2 mt -56.94 -47.65 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.385 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -67.62 -35.98 79.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.293 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.2 -46.65 5.8 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.183 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.733 ' HB2' HG12 ' A' ' 114' ' ' VAL . 43.7 m -73.4 -35.2 65.82 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.783 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 6.1 mt-10 -66.12 -37.24 85.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.864 0.756 . . . . 0.0 111.029 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -64.02 -42.24 97.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.869 0.366 . . . . 0.0 110.473 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.9 m -100.36 22.62 11.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.208 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.6 156.81 70.47 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.063 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -44.41 141.4 5.22 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.892 2.395 . . . . 0.0 111.819 177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.02 22.97 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.872 2.381 . . . . 0.0 113.666 -171.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -115.21 94.14 4.6 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -74.31 97.7 3.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.194 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.535 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 8.7 t70 -89.3 115.52 26.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.854 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -29.72 -63.35 0.13 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.18 1.55 . . . . 0.0 113.627 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 9.9 t -96.89 -12.84 22.96 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -175.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.795 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 3.1 mmm -86.75 -26.18 24.32 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -170.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.635 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -54.36 -44.89 72.58 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.076 0.941 . . . . 0.0 110.852 -171.458 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.635 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.8 t -57.84 -13.2 3.92 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.806 -1.543 . . . . 0.0 113.092 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.552 HD12 HG23 ' A' ' 111' ' ' THR . 1.7 mp -91.17 -37.97 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.48 -38.27 77.26 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.79 175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.733 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -78.95 -36.28 18.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 121.283 0.563 . . . . 0.0 110.265 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.47 -46.83 88.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.645 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.656 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 21.9 ptt? -69.57 -17.61 63.57 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.628 176.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.63 -30.1 64.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.756 0.788 . . . . 0.0 109.071 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -82.06 -39.77 22.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.669 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.6 -24.27 63.64 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 118.833 -1.147 . . . . 0.0 110.279 177.279 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.656 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.16 -54.99 27.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.991 160.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.54 -49.61 76.78 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 178.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.742 HG22 ' HA ' ' A' ' 119' ' ' LYS . 8.7 tt -57.77 -34.44 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 122.009 -0.432 . . . . 0.0 110.961 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.45 -29.5 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 177.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -63.04 -34.5 77.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.3 mt . . . . . 0 CA--C 1.54 0.575 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.182 173.905 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo . . . . . 0 N--CA 1.473 0.322 0 CA-C-O 121.009 0.337 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.62 -69.19 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.624 179.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -77.83 -10.7 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.075 0.464 . . . . 0.0 111.215 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.503 ' CE ' ' HA ' ' A' ' 5' ' ' MET . 2.6 tpt -65.33 -39.72 92.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.119 0.485 . . . . 0.0 110.065 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -82.41 103.48 12.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.743 174.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -63.74 148.43 49.18 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.46 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.457 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 9.7 mp -58.92 -52.65 64.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.088 -176.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.9 m -63.3 -33.28 75.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.738 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -72.43 -37.27 68.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.556 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.35 -54.73 13.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.853 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 24.8 m-85 -44.73 -69.11 0.15 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.646 171.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.73 33.93 63.91 Favored Glycine 0 C--N 1.342 0.899 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.05 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -67.46 -53.6 27.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 117.598 0.699 . . . . 0.0 109.537 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.427 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.79 88.17 1.89 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.106 0.479 . . . . 0.0 111.09 176.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.0 ttm -69.97 -35.53 74.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.09 -36.55 84.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.548 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -89.47 -25.27 21.55 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.687 -0.805 . . . . 0.0 111.452 -172.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.427 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -68.83 -35.69 77.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 170.051 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -61.55 -46.81 88.35 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.922 175.902 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -69.79 -43.62 71.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.867 -176.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -70.58 -33.61 71.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -174.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.663 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 7.0 mt -86.97 -4.5 59.18 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.434 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m 59.09 43.42 17.46 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.359 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 4.3 mm? -49.77 120.62 11.37 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.9 174.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.652 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 12.3 Cg_exo -72.67 154.4 54.49 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 121.941 1.761 . . . . 0.0 110.814 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.704 ' HA ' HG22 ' A' ' 30' ' ' VAL . 15.0 p-10 -64.13 -27.36 69.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.826 -176.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 m -65.93 -36.26 82.87 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.122 0.487 . . . . 0.0 110.381 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.445 HG11 ' CB ' ' A' ' 47' ' ' LEU . 19.9 t -82.35 -41.04 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.476 -176.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.4 m -58.87 -33.19 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.838 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.98 -51.95 53.86 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.539 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.9 -37.2 86.52 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.7 tp -51.48 -51.74 52.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.63 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -67.84 11.56 0.14 Allowed 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.597 HD22 ' HB3' ' A' ' 39' ' ' ASP . 27.5 p-10 -59.67 111.11 1.31 Allowed 'General case' 0 C--N 1.346 0.429 0 CA-C-N 120.522 1.51 . . . . 0.0 111.382 -174.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -95.46 -2.66 48.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.925 0.393 . . . . 0.0 111.249 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 p90 -91.14 160.51 15.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.139 177.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.879 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -73.26 80.23 1.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 122.074 0.94 . . . . 0.0 110.619 176.614 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB3' HD22 ' A' ' 35' ' ' ASN . 4.7 p-10 -44.82 -53.33 7.58 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.9 p30 49.02 33.06 4.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.595 0.758 . . . . 0.0 111.147 -169.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.56 177.37 4.87 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.69 -176.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.4 t -101.71 136.11 35.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.898 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.405 ' HB3' ' HE2' ' A' ' 43' ' ' MET . 51.8 ttp -70.75 101.46 2.1 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -97.72 -40.82 8.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.257 -173.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 47' ' ' LEU . 8.5 t70 -86.44 120.17 27.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.355 0.598 . . . . 0.0 112.052 -173.301 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.804 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -44.21 -42.28 6.4 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 114.493 -1.23 . . . . 0.0 113.155 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.701 HD22 ' HG2' ' A' ' 46' ' ' ARG . 3.7 mm? -64.67 -19.47 65.75 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 122.262 -0.274 . . . . 0.0 111.45 -175.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.531 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.08 -59.79 2.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -178.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.54 -47.46 2.95 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-N 115.097 -0.956 . . . . 0.0 114.467 166.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HB3' HD13 ' A' ' 23' ' ' LEU . 30.0 m -63.41 -43.76 96.6 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.489 1.144 . . . . 0.0 111.22 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.52 -23.79 66.29 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.531 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.0 mm -63.86 -34.24 66.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.108 0.48 . . . . 0.0 110.594 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -140.1 63.18 1.48 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.187 0.518 . . . . 0.0 111.277 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.431 ' CB ' HD11 ' A' ' 23' ' ' LEU . 28.7 p -114.54 -38.65 3.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 177.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.3 tt -62.72 -55.63 24.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.551 -170.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.1 -13.69 58.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.079 0.466 . . . . 0.0 110.42 -173.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.509 HG23 HG11 ' A' ' 61' ' ' VAL . 36.7 m -82.97 -35.89 25.56 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.54 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.449 ' HB3' ' NZ ' ' A' ' 58' ' ' LYS . 9.0 mtpm? -81.53 -16.03 53.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.265 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.2 mt -65.62 -65.32 0.69 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.255 170.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -175.7 121.31 0.19 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.706 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.509 HG11 HG23 ' A' ' 57' ' ' THR . 11.5 p -177.28 36.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.477 1.132 . . . . 0.0 109.12 -178.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.593 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.2 m -103.88 117.52 49.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.42 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -54.41 7.54 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.956 177.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -96.41 -145.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.911 2.407 . . . . 0.0 112.906 -173.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.468 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.1 m-20 -76.71 10.14 2.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.376 -176.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.72 -69.56 0.52 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.683 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.2 p30 -69.12 149.42 48.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.712 -0.744 . . . . 0.0 111.36 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 68' ' ' LEU . 4.0 mm? 69.7 31.69 3.5 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.593 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 16.5 p-80 -74.74 68.86 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.314 0.578 . . . . 0.0 110.878 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -86.39 -49.02 7.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.926 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.15 -53.7 43.54 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.582 -174.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -62.01 -27.67 69.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -36.64 73.22 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.672 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -80.03 -35.65 36.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.74 -37.58 88.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.402 173.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -63.07 -35.96 81.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.172 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.23 -37.05 74.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 81.0 mtp -74.44 -39.01 62.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.358 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -82.98 -12.34 57.38 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.804 0.335 . . . . 0.0 110.292 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -144.4 94.56 2.58 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.342 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.83 -64.94 0.47 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.046 -1.073 . . . . 0.0 113.428 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.23 138.34 41.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.032 0.444 . . . . 0.0 111.833 -175.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.612 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -84.05 174.46 10.27 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 172.246 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 30.1 mt-10 -62.22 -35.38 78.72 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.47 -167.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.798 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 12.7 t -61.76 -38.37 87.75 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.751 -177.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 65.4 mtm -81.32 -39.38 25.24 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -174.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.58 -39.74 89.17 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.279 173.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.73 -26.4 60.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.709 -177.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.798 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.7 mm-40 -78.46 -23.56 46.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.619 177.045 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.642 ' O ' HG13 ' A' ' 94' ' ' ILE . 3.4 mm? -85.26 -49.04 8.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.961 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 88' ' ' GLN . 19.9 m -57.99 -39.39 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -172.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.14 -43.06 71.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.869 0.366 . . . . 0.0 110.536 -176.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.762 HG23 ' SG ' ' A' ' 97' ' ' CYS . 3.2 mm -63.43 -42.12 95.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.335 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.686 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.8 mt -51.55 -47.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.622 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.1 m170 -70.87 -36.46 72.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.166 0.508 . . . . 0.0 110.639 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.55 -49.5 4.6 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.334 -172.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.773 ' HB2' HG12 ' A' ' 114' ' ' VAL . 57.9 m -71.39 -35.76 71.16 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.867 -177.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.686 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 1.3 mt-10 -63.92 -37.73 88.48 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.603 0.638 . . . . 0.0 110.88 172.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.22 -35.87 82.21 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.041 0.448 . . . . 0.0 110.546 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.5 m -107.43 25.51 11.36 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -87.32 149.64 47.41 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -175.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.16 149.24 81.6 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.364 2.043 . . . . 0.0 110.288 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -66.45 71.87 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.857 2.372 . . . . 0.0 113.146 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -99.73 91.66 4.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -81.2 77.27 8.11 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.962 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.723 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.7 t70 -145.3 128.43 16.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.733 174.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HE2' ' HB3' ' A' ' 107' ' ' LYS . 13.4 ttpt -29.25 -55.87 0.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 125.024 1.453 . . . . 0.0 114.508 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.444 ' CB ' ' HB2' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -93.72 -16.97 23.69 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.519 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 90.3 mmm -74.3 -32.14 62.76 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 121.841 -0.537 . . . . 0.0 111.731 -172.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.723 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -62.71 -49.53 74.71 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.692 0.758 . . . . 0.0 109.853 178.013 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.723 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.06 -14.21 6.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.468 175.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.501 ' O ' ' HG2' ' A' ' 116' ' ' MET . 0.5 OUTLIER -89.27 -39.71 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 12.2 t70 -62.94 -35.38 79.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.484 177.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.773 HG12 ' HB2' ' A' ' 97' ' ' CYS . 15.8 m -79.42 -38.15 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.025 0.441 . . . . 0.0 110.168 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.44 -49.1 78.92 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-O 121.544 0.688 . . . . 0.0 111.304 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.512 ' HA ' ' HD3' ' A' ' 119' ' ' LYS . 25.0 ptt? -69.58 -19.85 63.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.06 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.863 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 8.5 t -72.79 -24.17 60.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.482 ' HE1' ' HB3' ' A' ' 89' ' ' GLN . 57.6 t80 -77.76 -40.58 40.41 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.424 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.2 pttp -67.82 -29.62 68.82 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 118.725 -1.19 . . . . 0.0 110.348 176.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.863 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.99 -54.62 44.89 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.625 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.45 ' HG3' HD11 ' A' ' 93' ' ' ILE . 14.4 mm-40 -58.71 -52.03 67.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.844 176.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -54.91 -36.63 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -70.86 -32.15 69.07 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.302 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -71.18 -33.94 70.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.214 0.53 . . . . 0.0 110.393 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.546 173.782 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 98.5 Cg_endo . . . . . 0 CA--C 1.531 0.354 0 CA-C-O 120.653 0.189 . . . . 0.0 112.515 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -51.1 -70.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.784 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -78.98 -9.48 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 121.149 0.499 . . . . 0.0 111.183 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 26.0 ttt -71.48 -30.09 65.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.33 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HA ' ' HE3' ' A' ' 6' ' ' LYS . 1.8 tpmt? -89.28 103.84 16.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.768 176.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.586 ' HB2' ' HB3' ' A' ' 10' ' ' ASN . 6.3 m120 -84.85 127.57 34.21 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.771 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.3 mp -60.13 -52.99 63.0 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -176.136 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -64.57 -26.83 68.58 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.447 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.586 ' HB3' ' HB2' ' A' ' 7' ' ' ASN . 27.9 t-20 -75.62 -34.31 60.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.494 177.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -74.5 -55.4 5.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.943 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -50.08 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.94 45.28 81.5 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 120.669 -0.777 . . . . 0.0 113.051 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.53 -60.24 3.95 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.829 0.347 . . . . 0.0 110.988 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -150.5 93.76 2.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.54 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 ttp -74.07 -31.01 62.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.68 -30.42 63.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.252 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -88.06 -26.21 22.66 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.037 -175.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 82.8 m -75.71 -31.04 59.49 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 170.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 1.029 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 23.4 tptp -56.18 -50.11 72.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.327 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.775 -178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -69.74 -37.29 76.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -173.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.888 ' HB2' HD12 ' A' ' 25' ' ' LEU . 16.0 mt -86.22 -6.28 59.01 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.132 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.7 t 59.53 43.82 15.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.435 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 1.029 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 10.3 mp -50.14 124.87 18.14 Favored Pre-proline 0 N--CA 1.47 0.559 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.313 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.582 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 11.1 Cg_exo -71.86 151.26 56.73 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.256 1.971 . . . . 0.0 110.072 170.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 30' ' ' VAL . 1.5 p30 -66.29 -26.01 67.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.847 0.356 . . . . 0.0 111.218 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 p -65.76 -32.91 74.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.07 0.462 . . . . 0.0 110.7 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.492 HG11 ' HB2' ' A' ' 47' ' ' LEU . 23.8 t -79.04 -42.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.37 -177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 27' ' ' ASP . 34.8 m -59.61 -29.22 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.126 0.489 . . . . 0.0 109.745 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.65 -52.71 41.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.6 176.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.97 -36.31 81.91 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.323 0.583 . . . . 0.0 109.747 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.8 tp -47.09 -55.67 7.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.253 173.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -66.58 10.07 0.14 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -65.78 116.18 6.7 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 120.393 1.451 . . . . 0.0 109.895 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -78.26 -28.79 47.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.289 -176.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -82.66 98.08 8.85 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -174.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -91.35 67.5 5.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.984 -174.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -63.47 13.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.06 70.47 0.65 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 119.087 0.858 . . . . 0.0 110.096 -169.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -103.05 171.07 7.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.574 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.8 t -90.67 113.56 26.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.211 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.553 ' O ' HG21 ' A' ' 112' ' ' ILE . 40.4 ttm -79.25 95.5 5.67 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.809 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.1 p -93.22 -18.0 23.03 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -84.88 133.81 34.3 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.811 0.815 . . . . 0.0 110.517 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HE ' ' CG ' ' A' ' 106' ' ' ASP . 9.9 mpt_? -68.98 -31.49 70.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.084 -1.416 . . . . 0.0 109.769 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.582 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.4 mm? -75.11 -14.88 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.04 -58.29 2.75 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.453 ' O ' HG22 ' A' ' 52' ' ' ILE . . . -38.64 -45.01 1.91 Allowed Glycine 0 CA--C 1.534 1.261 0 CA-C-N 114.919 -1.037 . . . . 0.0 114.655 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.446 ' HB3' HD13 ' A' ' 23' ' ' LEU . 4.1 m -76.24 -44.92 35.27 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.473 1.136 . . . . 0.0 112.247 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.4 -23.87 63.78 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 49' ' ' GLY . 14.7 tt -71.72 -19.86 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 0.0 110.945 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -144.08 85.24 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.229 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 23.9 t -121.76 -45.24 2.29 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.55 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.433 ' H ' HD22 ' A' ' 55' ' ' LEU . 3.2 mm? -58.25 -49.07 78.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.97 0.414 . . . . 0.0 111.51 -174.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.53 -15.67 51.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.962 0.41 . . . . 0.0 110.921 -174.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -83.78 -34.63 24.72 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.396 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 43.2 mtpt -82.92 -12.92 56.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.199 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.27 -64.09 0.95 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.888 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -175.05 111.7 0.13 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.467 HG12 ' O ' ' A' ' 57' ' ' THR . 8.1 p -176.0 32.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-O 121.327 0.584 . . . . 0.0 111.497 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.583 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.8 m -109.65 117.58 54.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.28 -0.888 . . . . 0.0 111.659 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 69' ' ' HIS . 0.1 OUTLIER -65.73 -59.68 8.75 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.485 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.714 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 27.6 Cg_endo -104.87 -139.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.52 2.813 . . . . 0.0 112.607 -171.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.472 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -72.13 -0.3 11.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.153 -177.652 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.78 -75.7 0.27 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.995 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.714 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p30 -70.06 152.68 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.084 -0.558 . . . . 0.0 111.637 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 70.98 27.67 3.34 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.504 0.722 . . . . 0.0 112.325 174.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ASP . 4.4 p80 -74.65 68.12 1.62 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 111.119 171.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -87.49 -31.66 19.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.395 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.6 -63.33 3.77 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.953 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 7.9 m-80 -55.26 -25.43 33.66 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 122.913 0.485 . . . . 0.0 112.087 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.27 -38.09 75.01 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.38 0.61 . . . . 0.0 110.291 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.511 ' HE3' HD13 ' A' ' 94' ' ' ILE . 59.9 mmtt -81.5 -36.43 29.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.762 177.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.598 ' HB3' ' HA ' ' A' ' 72' ' ' ASN . 11.2 t70 -60.58 -40.67 92.58 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.361 174.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -60.83 -42.41 97.69 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.443 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.39 -30.25 68.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.434 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.473 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 84.7 mtp -74.23 -40.88 62.12 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.614 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 13.6 ptpt -94.28 -7.89 40.65 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.456 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.771 ' HB3' HD21 ' A' ' 8' ' ' LEU . 42.5 m-70 -139.91 90.82 2.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.36 176.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.38 -75.74 0.42 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.646 173.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -96.91 149.8 21.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.511 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.2 OUTLIER -84.37 169.4 14.65 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 173.092 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -67.05 -38.22 85.46 Favored 'General case' 0 N--CA 1.411 -2.405 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.148 -168.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.761 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.7 OUTLIER -62.21 -33.51 74.69 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.08 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 7.4 tpt -84.56 -39.98 18.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.493 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.98 -38.97 77.05 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.535 172.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.553 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -71.67 -23.83 61.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.197 -178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.761 ' HG2' ' O ' ' A' ' 85' ' ' THR . 9.0 mm-40 -77.21 -25.75 52.05 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.1 tp -86.95 -44.91 11.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.274 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.553 HG22 ' HA ' ' A' ' 88' ' ' GLN . 26.7 m -57.36 -34.46 46.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.281 -175.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.69 -44.07 78.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -65.46 -41.06 90.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.854 175.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.511 HD13 ' HE3' ' A' ' 74' ' ' LYS . 86.4 mt -55.45 -48.24 77.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.681 -177.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -72.28 -35.26 68.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.897 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.9 -43.71 7.52 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.879 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 93' ' ' ILE . 63.0 m -72.79 -34.54 66.98 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 121.398 -0.121 . . . . 0.0 110.789 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -57.41 -38.38 74.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.819 0.343 . . . . 0.0 110.732 170.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -64.77 -43.23 93.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.168 175.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.1 m -99.0 25.17 6.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.841 0.353 . . . . 0.0 111.745 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 102' ' ' PRO . . . -76.09 148.21 81.04 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.606 178.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 23.9 Cg_exo -64.42 151.38 85.73 Favored 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.672 2.248 . . . . 0.0 111.871 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.4 Cg_exo -70.55 59.3 2.01 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -121.61 116.72 25.13 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -81.12 93.17 6.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.919 0.39 . . . . 0.0 111.249 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.732 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 6.2 m-20 -130.03 97.65 4.53 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.318 0.58 . . . . 0.0 110.152 170.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -42.65 -49.05 5.58 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 176.321 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.06 -24.14 28.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.871 1.214 . . . . 0.0 112.16 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.732 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 2.4 mmm -85.54 -26.72 26.02 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.48 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.1 OUTLIER -56.78 -45.95 81.8 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.737 0.779 . . . . 0.0 111.311 -170.46 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.56 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -57.93 -14.06 5.62 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.288 177.363 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.553 HG21 ' O ' ' A' ' 43' ' ' MET . 3.7 mp -90.13 -37.14 9.21 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 176.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -60.09 -35.31 74.93 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.518 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 111' ' ' THR . 16.5 m -81.26 -34.97 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.79 84.44 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.243 0.544 . . . . 0.0 111.653 174.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.573 ' HA ' ' CE ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.523 179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.516 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 43.2 t -73.02 -23.12 60.57 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.863 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.8 t80 -79.76 -46.56 16.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.573 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.17 -25.21 64.24 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 118.499 -1.28 . . . . 0.0 109.345 177.6 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.561 ' HE3' ' O ' ' A' ' 116' ' ' MET . 3.5 ttmt -54.02 -55.69 24.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.166 169.297 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 27.4 mm-40 -59.11 -40.52 85.62 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.509 173.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.544 HD13 HD12 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -57.23 -35.23 47.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 118.467 0.576 . . . . 0.0 111.349 176.949 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -72.46 -31.67 65.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.115 0.484 . . . . 0.0 111.135 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -71.0 -22.35 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.556 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.544 HD12 HD13 ' A' ' 122' ' ' ILE . 96.6 mt . . . . . 0 CA--C 1.534 0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.727 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.483 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.3 Cg_exo . . . . . 0 C--O 1.224 -0.19 0 CA-C-O 120.649 0.187 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -49.25 -68.25 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.823 177.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.8 tp -78.15 -14.3 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.115 0.483 . . . . 0.0 111.447 -177.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.483 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.7 mmm -80.15 -21.43 43.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.5 tttp -90.56 114.11 26.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -88.99 135.04 33.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.457 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.7 mp -58.03 -48.15 80.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.173 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.5 m -60.83 -37.02 80.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.004 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -70.54 -37.22 74.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.841 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -72.09 -56.75 5.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.406 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -58.7 -79.94 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.95 42.08 69.49 Favored Glycine 0 C--N 1.344 0.99 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.726 -171.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -81.9 -36.98 27.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.211 0.529 . . . . 0.0 110.528 -176.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.06 55.74 1.38 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.574 0.702 . . . . 0.0 109.638 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' MET . . . . . 0.445 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 53.9 tpp -69.77 -37.71 76.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.709 -177.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -54.09 -38.07 64.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.594 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 30.2 mt-30 -90.67 -27.24 19.14 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.346 -0.542 . . . . 0.0 111.67 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 9.1 p -76.83 -33.04 57.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.777 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 8.9 tptp -57.91 -49.69 75.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.75 172.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.91 -39.94 72.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.393 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 3.2 tm-20 -68.57 -39.27 81.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.201 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -77.37 -4.71 46.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.122 0.487 . . . . 0.0 110.385 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.2 m 65.43 36.3 6.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.504 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.777 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 18.2 mt -65.07 120.09 64.18 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.786 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.581 ' CD ' HD21 ' A' ' 47' ' ' LEU . 7.9 Cg_exo -73.95 163.41 36.96 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.838 2.359 . . . . 0.0 110.444 171.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -62.34 -32.32 73.07 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.408 -174.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -63.95 -52.9 57.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 111.447 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.662 HG21 HD23 ' A' ' 47' ' ' LEU . 59.1 t -70.14 -53.38 23.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.75 -175.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.455 HG22 ' CE2' ' A' ' 34' ' ' TYR . 9.9 p -59.9 -30.01 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.007 -176.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.84 -51.48 40.04 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.05 -34.58 78.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.661 0.743 . . . . 0.0 109.388 178.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -53.82 -38.73 64.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.612 171.214 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.455 ' CE2' HG22 ' A' ' 30' ' ' VAL . 19.6 m-85 -76.28 9.13 2.76 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -65.4 108.01 1.83 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.915 0.78 . . . . 0.0 109.89 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -71.27 -33.57 69.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.732 -175.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 25.9 m-90 -74.13 126.84 31.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.468 0.652 . . . . 0.0 110.294 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.814 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -75.99 69.9 2.64 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.808 -178.711 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.636 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 29.1 t70 -43.62 -23.96 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 176.06 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.1 t0 67.32 71.4 0.36 Allowed 'General case' 0 C--N 1.351 0.637 0 CA-C-N 118.97 0.804 . . . . 0.0 109.553 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.636 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.2 p90 -124.19 169.84 11.33 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.758 -177.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -90.21 132.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 35.9 ttp -68.95 93.19 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.477 0.656 . . . . 0.0 109.621 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.9 p -88.33 -40.65 13.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.737 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.585 ' OD2' ' HB3' ' A' ' 47' ' ' LEU . 24.1 t70 -80.96 117.74 21.84 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 122.246 1.022 . . . . 0.0 111.059 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.724 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.33 -37.39 62.27 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.066 -1.879 . . . . 0.0 111.792 172.69 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.662 HD23 HG21 ' A' ' 29' ' ' VAL . 28.3 tp -71.27 -18.06 62.44 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 -173.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.42 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -51.87 8.13 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.95 -46.03 1.7 Allowed Glycine 0 CA--C 1.531 1.073 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.212 165.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.9 m -68.87 -43.42 75.39 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.393 1.097 . . . . 0.0 109.596 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.58 -9.47 58.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.354 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 48' ' ' ALA . 55.9 mt -59.22 -36.17 61.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.05 0.452 . . . . 0.0 110.282 175.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -135.47 84.77 2.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.3 p -102.26 -45.51 5.1 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.9 -178.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 59' ' ' LEU . 61.9 tp -60.64 -57.02 14.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.267 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.22 -15.69 54.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.009 0.433 . . . . 0.0 110.762 -170.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.605 HG23 HG11 ' A' ' 61' ' ' VAL . 96.0 m -74.79 -34.0 62.35 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.556 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 14.8 mmmt -79.36 -25.85 42.16 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.435 177.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.1 mm? -65.42 -64.29 0.9 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.846 172.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -176.27 117.17 0.13 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.691 0.282 . . . . 0.0 110.776 -175.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG23 ' A' ' 57' ' ' THR . 11.2 p -166.43 32.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.239 1.019 . . . . 0.0 109.338 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.715 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 35.5 m -111.28 120.68 62.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.176 -174.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.19 -56.15 2.04 Favored Pre-proline 0 CA--C 1.533 0.318 0 O-C-N 122.277 -0.264 . . . . 0.0 111.43 175.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 10.9 Cg_endo -97.04 -146.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.155 2.57 . . . . 0.0 112.682 -173.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.411 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -74.56 11.76 0.94 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.788 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.77 -68.88 0.54 Allowed Glycine 0 C--N 1.317 -0.49 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.316 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.8 p30 -70.0 149.5 47.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.43 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 68.69 31.73 4.45 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 173.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.715 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 13.3 p80 -73.9 72.6 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.583 0.706 . . . . 0.0 111.669 176.095 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -87.34 -47.52 8.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.044 -179.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.63 -59.07 11.51 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.89 -173.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -63.28 -24.18 67.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.29 -36.51 68.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.221 0.534 . . . . 0.0 110.378 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HZ1' ' HB1' ' A' ' 87' ' ' ALA . 3.1 mmmp? -79.91 -33.37 39.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.891 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 20.9 t70 -64.23 -42.1 96.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.084 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -63.89 -39.52 94.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.82 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.7 -33.7 72.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.164 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 68.7 mtm -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.961 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 3.7 ptpp? -93.16 -14.16 27.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.867 -0.733 . . . . 0.0 111.583 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.868 ' HB3' HD21 ' A' ' 8' ' ' LEU . 35.4 m80 -139.08 92.64 2.61 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.403 178.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.27 -75.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.579 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.22 146.22 30.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.579 0.228 . . . . 0.0 110.559 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.686 ' OD1' HG22 ' A' ' 85' ' ' THR . 2.5 p30 -87.54 174.71 8.31 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.343 0.592 . . . . 0.0 110.643 173.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -49.46 69.95 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.56 -166.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.76 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.1 t -62.76 -32.27 73.39 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.465 -175.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 72.0 mtp -79.59 -39.46 31.65 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.447 0.641 . . . . 0.0 109.53 -173.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.507 ' HB1' ' HZ1' ' A' ' 74' ' ' LYS . . . -63.14 -31.64 72.84 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.507 176.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.822 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -82.35 -19.61 38.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.8 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.76 ' HG2' ' O ' ' A' ' 85' ' ' THR . 75.4 mm-40 -78.58 -23.68 45.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 94' ' ' ILE . 24.9 tp -85.98 -43.86 12.82 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.006 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.822 HG22 ' HA ' ' A' ' 88' ' ' GLN . 2.8 m -57.67 -29.73 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -175.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -68.08 -43.02 79.51 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.265 0.555 . . . . 0.0 109.865 -178.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.625 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.01 -42.05 85.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.058 175.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.645 HG13 ' O ' ' A' ' 90' ' ' LEU . 27.2 mt -54.95 -47.59 76.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 CA-C-O 120.921 0.391 . . . . 0.0 110.174 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -70.22 -37.07 74.95 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.826 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.94 -48.39 5.2 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.277 -173.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.807 ' HB2' HG12 ' A' ' 114' ' ' VAL . 39.7 m -72.98 -37.42 67.05 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -67.36 -37.36 83.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 117.969 0.349 . . . . 0.0 110.494 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.34 -33.4 75.77 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.814 0.34 . . . . 0.0 110.577 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.7 m -97.73 8.11 45.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.324 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.24 155.51 79.44 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.885 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.512 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 59.6 Cg_exo -52.88 138.21 60.85 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.75 2.3 . . . . 0.0 111.977 176.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.7 Cg_exo -71.28 35.1 0.27 Allowed 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.592 2.861 . . . . 0.0 113.208 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -95.94 119.47 34.49 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.97 96.03 4.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.435 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.943 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.5 t70 -144.38 119.03 9.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.346 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -29.92 -71.83 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.074 1.484 . . . . 0.0 113.776 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.42 ' O ' HD13 ' A' ' 112' ' ' ILE . 81.6 m -88.79 -14.72 36.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -174.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.943 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -63.12 -42.62 99.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.703 0.683 . . . . 0.0 110.453 -178.926 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.668 ' HG3' ' H ' ' A' ' 111' ' ' THR . 0.6 OUTLIER -64.44 -49.97 69.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.651 0.738 . . . . 0.0 110.422 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.668 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -59.04 -13.4 6.6 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.913 175.777 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -88.3 -35.86 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.625 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.2 OUTLIER -59.81 -37.56 79.5 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.046 173.254 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.807 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.7 m -78.02 -38.29 24.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.733 178.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.07 -52.59 64.71 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 121.006 0.432 . . . . 0.0 111.739 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.648 ' SD ' ' HE2' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.4 -24.68 63.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.58 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.92 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 13.8 t -69.09 -25.43 64.42 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.594 0.712 . . . . 0.0 110.142 176.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.609 ' HA ' HG12 ' A' ' 93' ' ' ILE . 75.1 t80 -79.81 -43.09 23.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.133 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.6 pttp -68.12 -28.1 67.04 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.736 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.92 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.42 -54.95 41.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.709 0.29 . . . . 0.0 111.008 173.211 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HG3' ' N ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -59.52 -47.59 84.94 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.346 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.542 ' N ' ' HG3' ' A' ' 121' ' ' GLU . 1.9 tt -59.85 -31.24 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 120.932 0.396 . . . . 0.0 110.943 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -70.6 -30.86 67.65 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 176.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -36.15 69.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.407 174.345 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 N--CA 1.466 -0.132 0 CA-C-O 120.709 0.212 . . . . 0.0 111.738 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 15.7 mp0 -49.93 -69.56 0.11 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.934 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -78.19 -12.94 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.05 0.453 . . . . 0.0 111.495 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 74.5 mmm -79.5 -21.83 44.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 110.958 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -89.11 103.84 16.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.967 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -62.44 136.17 57.78 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.916 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.683 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.5 pt? -56.4 -42.96 78.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.843 178.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.763 ' HB3' HD13 ' A' ' 55' ' ' LEU . 50.8 m -61.44 -30.28 70.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -74.7 -31.66 61.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.083 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -75.6 -49.36 18.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.145 176.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -46.7 -74.2 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 172.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.3 46.04 87.35 Favored Glycine 0 C--N 1.34 0.751 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.661 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.604 ' H ' HD23 ' A' ' 55' ' ' LEU . 87.9 tttt -67.76 -62.03 1.6 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 117.057 0.429 . . . . 0.0 110.987 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.87 102.83 3.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.551 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.4 mmt -70.65 -25.29 62.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.17 0.51 . . . . 0.0 110.168 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.45 -31.11 70.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.777 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -88.87 -25.63 22.05 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.85 -170.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 99.7 m -74.25 -34.58 63.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.189 0.519 . . . . 0.0 109.764 173.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -62.2 -47.29 85.12 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.893 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -76.14 -48.15 21.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.678 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.82 -32.3 72.75 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -174.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.583 ' CB ' HD13 ' A' ' 25' ' ' LEU . 4.1 mm? -88.9 -17.42 29.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.667 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 60.61 36.25 19.77 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -170.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.71 HD23 HG12 ' A' ' 30' ' ' VAL . 2.0 tp -57.08 121.81 49.06 Favored Pre-proline 0 N--CA 1.456 -0.138 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.801 -172.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 17.9 Cg_exo -68.54 155.67 68.22 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.694 2.263 . . . . 0.0 110.804 173.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.697 ' HA ' HG22 ' A' ' 30' ' ' VAL . 52.7 p30 -70.9 -20.53 62.49 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.587 -175.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 m -66.38 -37.52 85.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 109.876 173.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG21 ' HD2' ' A' ' 26' ' ' PRO . 61.7 t -73.58 -51.43 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.885 -177.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.71 HG12 HD23 ' A' ' 25' ' ' LEU . 35.5 m -57.42 -36.31 52.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 120.937 0.399 . . . . 0.0 110.931 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.62 -51.71 57.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.731 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.14 -25.25 60.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.144 0.497 . . . . 0.0 110.167 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.6 tp -56.59 -52.75 63.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.406 174.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -74.57 10.04 1.52 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -65.36 126.21 27.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.852 0.751 . . . . 0.0 111.184 -175.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -82.87 -35.05 26.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.349 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -72.73 134.25 44.92 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.005 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -77.54 67.76 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.217 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -43.69 -54.71 4.87 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 171.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.0 t70 64.63 70.35 0.49 Allowed 'General case' 0 C--N 1.347 0.472 0 CA-C-O 121.699 0.762 . . . . 0.0 109.919 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -125.59 178.66 5.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.158 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 62.0 t -83.69 128.88 38.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 51.0 ttm -68.03 92.44 0.38 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.253 0.549 . . . . 0.0 109.669 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.1 p -92.12 -32.63 15.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.493 -174.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.44 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 13.7 t70 -70.87 129.84 40.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.401 0.62 . . . . 0.0 111.227 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.402 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 1.6 mpt_? -75.2 -20.88 59.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.296 -175.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 25' ' ' LEU . 3.4 mm? -78.34 -15.73 58.42 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.109 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.0 -62.49 1.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -177.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.714 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -41.3 -48.12 4.55 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 114.845 -1.071 . . . . 0.0 114.475 169.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.3 m -66.97 -42.63 84.81 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.541 1.171 . . . . 0.0 111.794 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.01 -18.83 65.6 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 48' ' ' ALA . 46.3 mm -54.67 -40.25 50.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.277 175.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -118.6 77.15 1.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.024 177.226 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 t -125.28 -46.72 1.77 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.278 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 9' ' ' SER . 7.5 mp -66.77 -74.95 0.1 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.413 0.625 . . . . 0.0 111.743 -170.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.14 -3.22 54.41 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.326 0.584 . . . . 0.0 110.069 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.527 ' HA ' HG11 ' A' ' 61' ' ' VAL . 81.1 m -83.63 -35.99 24.2 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.354 173.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.1 mtpt -77.49 -15.52 59.25 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.056 172.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 tp -64.94 -66.41 0.55 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.529 172.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 22.2 t70 -176.22 121.26 0.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.5 p -179.47 43.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.622 0.725 . . . . 0.0 111.655 -176.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.576 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.3 m -105.97 121.46 58.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 110.366 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -64.55 -55.21 31.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.794 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.5 Cg_endo -97.72 -138.85 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.233 2.622 . . . . 0.0 113.298 -172.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -71.28 -5.51 32.79 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.226 -173.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 140.27 -56.75 0.61 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -170.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.6 p-10 -84.32 149.47 26.03 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.085 -0.557 . . . . 0.0 111.029 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.46 46.43 1.03 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.34 0.591 . . . . 0.0 110.799 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -75.14 81.42 2.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.534 0.683 . . . . 0.0 111.32 178.678 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -86.0 -63.25 1.35 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.232 -175.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.32 -60.27 8.88 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 121.278 -0.487 . . . . 0.0 113.05 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.409 ' HA ' HD21 ' A' ' 72' ' ' ASN . 0.6 OUTLIER -55.49 -29.04 58.06 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.453 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.29 -37.18 66.32 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.056 0.455 . . . . 0.0 110.919 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 78' ' ' MET . 72.6 mmtt -79.33 -33.67 42.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.04 -39.98 95.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.379 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.507 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 42.4 t80 -63.65 -32.51 74.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.396 177.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.71 -32.94 71.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.651 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 55.0 mtt -69.39 -28.12 65.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.859 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 76' ' ' PHE . 49.3 mtmt -86.31 -15.65 39.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.065 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -145.58 96.0 2.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.664 0.269 . . . . 0.0 111.199 -176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.08 -62.99 0.51 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.396 -0.906 . . . . 0.0 112.48 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -104.08 139.48 39.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.746 0.308 . . . . 0.0 111.032 -177.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.634 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -88.11 175.97 7.49 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.408 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -54.47 -38.36 66.3 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.747 -171.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.634 HG22 ' OD1' ' A' ' 83' ' ' ASP . 8.3 t -73.69 -25.09 60.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.497 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.574 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 54.0 mtt -84.62 -39.61 18.46 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.51 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -65.38 -39.26 92.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.352 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.452 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.61 -25.37 53.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.422 -174.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.548 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 4.0 pt20 -83.1 -23.43 33.06 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.334 -0.547 . . . . 0.0 110.071 173.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.1 tt -82.97 -48.17 10.96 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.481 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -57.33 -36.19 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.883 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -65.77 -41.3 92.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.009 0.433 . . . . 0.0 110.568 -176.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.547 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.4 mp -62.46 -42.59 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.694 176.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 90' ' ' LEU . 34.2 mt -56.97 -48.13 82.16 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.152 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -67.0 -34.69 78.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.208 0.528 . . . . 0.0 110.233 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -48.81 5.57 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.705 -172.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 11.7 m -74.82 -31.45 61.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.734 -0.651 . . . . 0.0 112.669 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.586 ' CG ' HG11 ' A' ' 114' ' ' VAL . 37.5 mt-10 -57.36 -37.15 72.16 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.328 0.967 . . . . 0.0 109.833 166.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.79 -43.53 62.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.8 m -97.68 15.51 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.06 154.38 72.51 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.467 0.175 . . . . 0.0 110.573 177.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.42 ' HB2' ' OD1' ' A' ' 104' ' ' ASN . 13.8 Cg_exo -69.45 163.12 39.23 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.831 2.354 . . . . 0.0 110.939 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.44 40.72 0.29 Allowed 'Trans proline' 0 CA--C 1.534 0.515 0 C-N-CA 123.17 2.58 . . . . 0.0 113.379 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 102' ' ' PRO . 2.6 m-20 -83.07 93.69 7.65 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -81.57 94.48 6.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.984 0.421 . . . . 0.0 110.825 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.823 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 10.1 t70 -133.14 107.36 8.15 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -28.79 -58.74 0.13 Allowed 'General case' 0 N--CA 1.473 0.693 0 O-C-N 124.967 1.417 . . . . 0.0 114.59 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.22 -15.99 22.83 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.823 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 12.9 ttt -85.18 -25.49 27.36 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -167.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.17 -47.08 86.61 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.292 1.044 . . . . 0.0 110.741 -177.51 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.709 HG22 HD12 ' A' ' 112' ' ' ILE . 0.3 OUTLIER -53.94 -14.33 0.99 Allowed 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.29 174.308 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.714 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.6 mp -91.95 -41.68 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 1.0 OUTLIER -62.78 -32.43 73.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.735 176.644 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -80.39 -35.21 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 CA-C-O 121.211 0.529 . . . . 0.0 110.143 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.75 78.09 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.812 0.815 . . . . 0.0 111.557 174.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.715 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.57 -19.34 64.47 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.845 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.595 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 6.6 t -69.48 -30.32 68.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.105 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.537 ' HA ' HG12 ' A' ' 93' ' ' ILE . 62.9 t80 -70.99 -43.38 68.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.844 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 0.9 OUTLIER -69.35 -29.63 67.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.95 -1.1 . . . . 0.0 110.501 176.322 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.715 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -56.1 -47.88 77.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.413 0.625 . . . . 0.0 109.97 168.091 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.529 ' HG2' HD11 ' A' ' 93' ' ' ILE . 9.4 tp10 -57.09 -50.0 74.15 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.595 176.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -56.63 -31.26 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 120.629 0.252 . . . . 0.0 111.211 177.763 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -71.74 -32.09 67.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.66 ' HD3' ' O ' ' A' ' 124' ' ' LYS . 9.8 tmtt? -72.15 -27.9 62.9 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 115.135 -0.938 . . . . 0.0 111.976 179.384 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo . . . . . 0 CA--C 1.527 0.17 0 CA-C-O 120.715 0.214 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -46.48 -66.12 0.45 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.533 HD13 ' HB2' ' A' ' 82' ' ' ALA . 8.3 tp -81.3 -10.33 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.915 0.388 . . . . 0.0 111.56 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.35 -23.69 57.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.127 0.489 . . . . 0.0 110.037 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -91.12 114.92 27.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.273 172.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -62.35 138.79 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.964 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.18 -40.06 70.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.691 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 p -64.62 -34.85 79.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.144 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -71.58 -33.78 69.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.334 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.65 -53.87 24.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.549 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -46.67 -71.91 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.935 169.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.43 37.44 60.23 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.683 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -80.78 -49.72 10.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.152 0.501 . . . . 0.0 110.061 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -160.12 106.14 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.419 177.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 61.3 mtm -76.83 -21.15 55.47 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 175.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 32.0 t70 -58.8 -27.63 65.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.092 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.7 pt20 -84.07 -24.74 30.26 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.116 0.484 . . . . 0.0 109.884 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 63.5 m -73.45 -29.89 62.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 55.7 tptt -62.67 -53.42 54.72 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.721 177.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -69.69 -43.77 71.79 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.041 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -69.51 -41.18 76.4 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.293 -174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 7.1 mt -82.07 -16.58 49.59 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.613 -177.099 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.0 m 57.79 43.31 22.06 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.596 HD23 HD12 ' A' ' 47' ' ' LEU . 50.1 mt -57.65 129.71 81.25 Favored Pre-proline 0 N--CA 1.468 0.433 0 CA-C-N 114.669 -1.151 . . . . 0.0 110.262 -175.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 20.6 Cg_exo -65.88 155.83 67.34 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 121.95 1.767 . . . . 0.0 110.449 173.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.85 -34.82 70.13 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.069 0.462 . . . . 0.0 111.032 -176.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 m -70.18 -42.1 72.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.235 -176.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.566 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.4 t -72.62 -53.85 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.63 -173.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.684 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.9 p -59.64 -30.64 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.177 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.87 -52.46 56.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.75 175.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.25 -38.1 68.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -176.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.684 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 2.4 pp -61.43 -32.56 72.53 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.742 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -64.67 8.18 0.13 Allowed 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 174.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -67.05 111.99 4.15 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.272 1.396 . . . . 0.0 111.011 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.31 -4.36 58.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.05 0.452 . . . . 0.0 110.56 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -90.03 145.29 25.19 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -83.31 58.53 4.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.437 0.637 . . . . 0.0 110.636 -178.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 5.5 t70 -42.6 -40.68 2.78 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.524 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 40.9 m-20 78.62 25.41 0.54 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.783 0.72 . . . . 0.0 111.155 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.43 175.82 9.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 0.0 110.957 178.189 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.32 124.56 52.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttm -78.84 92.74 4.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.049 0.452 . . . . 0.0 110.484 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 -30.91 13.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.71 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.39 135.14 48.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 122.005 0.907 . . . . 0.0 110.827 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.851 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 1.5 mpt_? -73.69 -30.94 63.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.845 -1.525 . . . . 0.0 109.919 -170.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.596 HD12 HD23 ' A' ' 25' ' ' LEU . 4.1 mm? -73.64 -15.63 61.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.032 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.88 -59.22 2.49 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.941 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -38.82 -47.07 2.35 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 115.361 -0.836 . . . . 0.0 114.057 166.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -66.5 -41.07 89.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.452 1.126 . . . . 0.0 111.752 177.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.9 -18.06 65.2 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.2 mm -56.78 -37.34 52.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.921 0.391 . . . . 0.0 110.671 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.422 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 60.3 t30 -141.08 86.59 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 0.0 110.307 178.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.7 p -106.82 -46.85 3.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.473 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -68.2 -44.98 74.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.086 -174.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.26 -13.32 58.61 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.9 0.381 . . . . 0.0 110.246 -174.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.672 ' HA ' HG11 ' A' ' 61' ' ' VAL . 91.3 m -79.05 -34.56 43.68 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.297 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -75.93 -20.93 57.58 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.433 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.5 mt -65.42 -66.19 0.58 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.482 175.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -177.19 116.59 0.1 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.672 HG11 ' HA ' ' A' ' 57' ' ' THR . 7.0 p -173.31 32.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 121.313 0.578 . . . . 0.0 111.52 -174.123 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.629 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 23.4 m -109.55 115.88 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 121.161 -0.962 . . . . 0.0 111.992 -175.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -74.51 -54.5 3.04 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.766 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.643 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 18.7 Cg_endo -99.15 -141.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 123.134 2.556 . . . . 0.0 113.246 -172.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.503 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 17.9 m-20 -75.45 10.1 1.84 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.668 -175.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.38 -75.32 0.42 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.206 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.624 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.1 p30 -70.35 152.86 43.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.962 -0.619 . . . . 0.0 110.8 177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 68' ' ' LEU . 3.9 mm? 69.13 34.81 2.92 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.574 0.546 . . . . 0.0 112.106 173.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 6.4 p-80 -73.31 77.53 1.34 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.738 0.78 . . . . 0.0 110.514 174.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -86.41 -61.71 1.68 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.746 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.94 56.21 Favored Glycine 0 CA--C 1.51 -0.275 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.444 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -58.71 -28.53 65.9 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.181 . . . . 0.0 111.44 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.566 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.23 -37.15 66.49 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.697 -0.627 . . . . 0.0 110.885 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.9 mmmt -81.03 -31.42 34.57 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.111 178.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.73 -40.31 95.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.327 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.415 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 64.2 t80 -62.98 -32.35 73.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.89 -38.62 79.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.69 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.569 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 66.0 mtm -69.26 -27.69 65.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.315 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.947 ' HE3' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -91.42 -12.44 34.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.46 179.266 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -141.33 90.98 2.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 O-C-N 122.183 -0.323 . . . . 0.0 111.042 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 109.55 -62.49 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.432 -0.89 . . . . 0.0 113.524 173.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.569 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.38 124.36 34.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.634 0.254 . . . . 0.0 110.912 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 4.6 p-10 -83.75 171.34 13.27 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.551 174.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -48.54 72.61 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.393 -164.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.775 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.0 t -61.0 -36.74 80.28 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.054 -173.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 50.4 mtm -81.01 -38.96 26.64 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.409 0.623 . . . . 0.0 109.5 -173.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.55 -39.64 84.65 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.165 173.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.49 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.32 -25.92 61.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.368 -177.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.775 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.1 mm-40 -77.99 -25.58 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 tp -88.13 -46.36 9.35 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.494 -176.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.4 m -56.92 -36.61 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.108 -173.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -65.73 -42.37 91.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.901 0.381 . . . . 0.0 110.579 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.576 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.6 mp -61.85 -38.88 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.041 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 47.1 mt -59.91 -45.79 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.209 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -68.51 -34.45 75.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.29 -49.68 5.13 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.47 -0.872 . . . . 0.0 112.244 -173.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 7.7 m -73.33 -31.23 63.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.563 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.765 ' HG3' HG11 ' A' ' 114' ' ' VAL . 18.8 mt-10 -65.29 -34.43 78.32 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.401 1.001 . . . . 0.0 110.271 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -64.81 -44.03 91.22 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.171 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.6 m -101.49 9.11 41.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -174.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -67.66 150.34 97.87 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.5 159.75 15.72 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 0.0 111.358 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.48 23.88 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.535 2.157 . . . . 0.0 113.078 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -94.71 91.92 6.75 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.48 95.98 7.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.558 0.694 . . . . 0.0 110.427 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.75 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.4 t70 -101.26 133.69 45.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.791 177.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -29.39 -72.32 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 O-C-N 125.327 1.642 . . . . 0.0 112.947 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.0 t -96.41 -21.79 17.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.851 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 59.1 ttp -77.39 -15.75 59.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.883 -0.51 . . . . 0.0 112.237 -168.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.428 ' CG ' ' H ' ' A' ' 111' ' ' THR . 12.1 ptmm? -56.27 -51.76 66.99 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 122.431 1.11 . . . . 0.0 109.355 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.428 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -60.18 -13.0 10.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.446 173.011 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.941 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -89.02 -40.58 13.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.29 -37.26 84.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.652 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.765 HG11 ' HG3' ' A' ' 98' ' ' GLU . 12.1 m -77.61 -35.67 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.885 178.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.27 76.55 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.17 0.51 . . . . 0.0 111.204 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.539 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 21.6 ptt? -69.79 -17.91 63.44 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.478 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.968 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 39.5 t -69.46 -32.78 71.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 122.143 0.973 . . . . 0.0 109.022 176.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -74.11 -38.11 63.93 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.93 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.589 ' C ' ' HD2' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -67.66 -26.37 66.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 118.364 -1.334 . . . . 0.0 111.629 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.968 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -64.72 -56.36 14.19 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.539 -1.265 . . . . 0.0 109.354 172.05 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.0 -41.65 88.17 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.944 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -35.18 56.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.305 0.502 . . . . 0.0 110.697 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -72.06 -30.52 65.23 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 176.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -72.5 -33.71 67.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.121 0.486 . . . . 0.0 110.146 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 CA--C 1.536 0.429 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.412 171.284 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.435 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 82.1 Cg_endo . . . . . 0 N--CA 1.458 -0.58 0 N-CA-C 112.645 0.209 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -50.17 -70.61 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.903 0.752 . . . . 0.0 112.376 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.456 HD12 ' HB2' ' A' ' 82' ' ' ALA . 14.5 tt -87.2 -10.75 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.61 177.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.435 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 51.1 ttp -62.65 -40.76 98.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.469 0.652 . . . . 0.0 109.53 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -92.18 100.59 13.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.568 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 10' ' ' ASN . 57.2 m-80 -61.54 124.77 21.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.309 -172.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.12 -30.61 71.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.143 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 3.4 p -69.31 -35.34 75.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.577 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -72.4 -26.59 61.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.278 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.55 -40.01 84.98 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.507 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 33.0 m-85 -55.02 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.341 168.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.64 36.08 17.73 Favored Glycine 0 C--N 1.346 1.085 0 C-N-CA 121.108 -0.568 . . . . 0.0 113.747 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 2.2 tmmm? -65.88 -39.14 90.4 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.026 0.441 . . . . 0.0 110.58 -177.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.01 96.91 2.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.131 0.491 . . . . 0.0 111.498 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -80.14 -32.71 38.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -56.59 -40.49 75.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.307 -1.315 . . . . 0.0 111.693 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -88.12 -24.78 23.29 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.42 -169.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.2 t -73.37 -36.07 66.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 119.949 -0.7 . . . . 0.0 109.138 173.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 1.095 ' HA ' HD13 ' A' ' 25' ' ' LEU . 10.6 tptt -63.44 -39.29 94.09 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.643 0.735 . . . . 0.0 109.877 176.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -69.19 -40.92 77.76 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.651 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -71.46 -44.47 64.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.769 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 10.6 mt -86.35 -4.8 59.24 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.463 -175.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.3 t 63.3 34.26 13.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.509 176.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 1.095 HD13 ' HA ' ' A' ' 20' ' ' LYS . 6.4 mp -50.42 119.24 10.66 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.931 -176.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.0 Cg_exo -73.75 162.89 38.55 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.979 2.453 . . . . 0.0 111.655 174.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.624 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.4 p-10 -62.81 -29.67 70.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -174.021 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 t -68.18 -37.61 81.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.339 0.59 . . . . 0.0 110.03 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.926 HG21 HD23 ' A' ' 47' ' ' LEU . 41.5 t -75.45 -49.96 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.706 -177.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.624 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.6 m -55.91 -35.12 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.672 0.272 . . . . 0.0 110.749 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.57 69.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 0.0 111.632 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -68.43 -38.33 81.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.9 0.857 . . . . 0.0 109.17 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 3.1 tm? -55.76 -55.67 29.61 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.996 175.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -67.9 12.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -56.19 110.96 0.84 Allowed 'General case' 0 C--N 1.35 0.6 0 CA-C-N 120.051 1.296 . . . . 0.0 110.547 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -78.71 -27.86 45.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.679 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -88.3 157.77 18.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 -174.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.505 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 7.1 mptt -82.83 61.24 5.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.764 -175.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.588 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 1.0 OUTLIER -43.79 -48.21 8.12 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.628 176.108 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 68.19 19.68 9.06 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 118.258 0.481 . . . . 0.0 111.016 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.588 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -78.42 179.12 7.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.005 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 t -89.66 130.61 38.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.318 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 42.3 ttm -65.29 104.47 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.089 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.0 p -87.25 -40.62 14.36 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -173.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.514 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 6.2 t70 -90.64 117.48 29.33 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-O 122.284 1.04 . . . . 0.0 110.718 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.58 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.02 -38.45 62.38 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 113.161 -1.836 . . . . 0.0 112.242 175.551 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.926 HD23 HG21 ' A' ' 29' ' ' VAL . 46.5 tp -68.82 -18.18 64.13 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.939 0.399 . . . . 0.0 111.05 -174.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.7 -55.99 5.01 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.72 -45.37 1.48 Allowed Glycine 0 CA--C 1.533 1.159 0 CA-C-N 114.727 -1.124 . . . . 0.0 114.41 165.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 57.5 m -65.54 -43.41 90.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 118.09 0.945 . . . . 0.0 110.319 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -68.39 -25.45 65.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.776 -176.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.4 mt -77.24 -26.66 15.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 110.33 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.76 44.36 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 -45.18 2.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.5 -170.191 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 3.2 mm? -46.46 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.19 -15.49 53.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.811 0.338 . . . . 0.0 110.899 -172.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.421 HG23 HG11 ' A' ' 61' ' ' VAL . 1.5 m -78.62 -32.06 47.26 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.746 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.612 ' HB3' ' NZ ' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.52 -23.43 34.61 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.779 174.289 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 10.6 mt -63.38 -59.95 4.01 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 121.179 -0.209 . . . . 0.0 111.249 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -174.01 122.53 0.31 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -176.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HB3' ' A' ' 72' ' ' ASN . 9.8 p -177.11 33.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 121.59 0.71 . . . . 0.0 111.142 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.651 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 35.5 m -98.3 114.07 34.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 O-C-N 121.25 -0.907 . . . . 0.0 110.579 -176.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -56.75 4.1 Favored Pre-proline 0 CA--C 1.53 0.198 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.237 -176.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.585 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 4.4 Cg_endo -91.81 -144.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.815 2.343 . . . . 0.0 112.715 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -74.64 10.5 1.34 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.371 -176.393 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.01 -75.55 0.31 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.572 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.585 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p30 -75.06 168.61 19.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.051 -0.575 . . . . 0.0 111.075 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 70.12 28.62 3.99 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 123.76 0.663 . . . . 0.0 111.952 173.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 13.1 p-80 -76.83 65.9 2.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.402 0.62 . . . . 0.0 110.832 172.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -88.9 -49.75 6.61 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.138 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.11 -51.86 54.84 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.502 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.434 ' HB3' HG22 ' A' ' 61' ' ' VAL . 1.6 t-20 -59.24 -35.65 74.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.72 -0.24 . . . . 0.0 111.512 -176.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.86 -37.07 70.28 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.1 0.476 . . . . 0.0 111.068 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.606 ' O ' ' HG3' ' A' ' 78' ' ' MET . 5.2 mmmp? -80.64 -36.14 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.828 -178.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.489 ' HA ' ' HE2' ' A' ' 78' ' ' MET . 26.0 t70 -65.58 -41.04 93.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -60.63 -37.8 82.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.088 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.79 71.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.298 178.137 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.1 mtm -74.36 -34.96 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.797 0.332 . . . . 0.0 111.803 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -93.88 -8.42 40.34 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.93 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -141.89 88.53 2.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.72 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.17 -74.79 0.43 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.424 -0.893 . . . . 0.0 112.621 177.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.532 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -107.66 141.13 39.64 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 165.63 23.77 Favored 'General case' 0 CA--C 1.489 -1.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 11.2 pt-20 -67.49 -21.39 65.51 Favored 'General case' 0 N--CA 1.409 -2.484 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.628 -164.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.71 -28.2 63.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.643 -179.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 38.8 mtt -83.74 -39.76 19.69 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.578 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.59 -37.74 87.51 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.718 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.71 -27.01 50.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.8 -174.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -79.96 -24.19 41.15 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.209 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.492 ' O ' HG13 ' A' ' 94' ' ' ILE . 25.6 tp -81.41 -46.15 15.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.13 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 87' ' ' ALA . 17.7 m -57.57 -33.32 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.959 -175.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.77 -45.16 87.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.326 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.66 -40.0 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 91' ' ' VAL . 74.2 mt -54.43 -50.05 60.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.275 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -71.76 -33.41 68.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.645 -174.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.1 -49.55 5.53 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.684 -174.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 114' ' ' VAL . 0.1 OUTLIER -72.63 -28.59 62.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.796 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.51 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.9 tt0 -62.33 -38.62 90.15 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.672 0.273 . . . . 0.0 111.405 170.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -67.43 -33.69 75.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.893 0.378 . . . . 0.0 110.481 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.5 m -96.38 8.76 43.2 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.279 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.61 155.59 87.22 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.705 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 92.2 Cg_exo -45.08 140.59 7.25 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.159 2.573 . . . . 0.0 112.425 176.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.8 Cg_exo -69.59 24.81 0.17 Allowed 'Trans proline' 0 N--CA 1.476 0.469 0 C-N-CA 123.695 2.93 . . . . 0.0 113.703 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' A' ' 102' ' ' PRO . 89.3 m-20 -109.04 93.95 4.78 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -76.46 95.13 3.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.654 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.7 t70 -121.2 124.42 44.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.275 172.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.581 ' HD2' ' H ' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -33.81 -51.31 0.39 Allowed 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -178.346 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.581 ' H ' ' HD2' ' A' ' 107' ' ' LYS . 91.4 m -92.4 -30.71 15.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.654 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 62.6 mmm -61.67 -46.08 91.27 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 122.1 0.953 . . . . 0.0 110.162 -176.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.68 ' O ' HG13 ' A' ' 114' ' ' VAL . 15.8 ptmt -66.09 -50.56 63.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.485 -178.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -58.66 -15.33 11.28 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.27 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.5 mp -89.16 -39.67 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -38.97 87.44 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.188 174.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 110' ' ' LYS . 2.8 m -80.13 -39.33 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 121.497 0.665 . . . . 0.0 110.11 -173.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.78 -41.39 99.23 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.03 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.659 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -67.33 -24.52 65.74 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.49 -177.751 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 86.6 m -66.63 -30.74 71.08 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.183 0.516 . . . . 0.0 109.943 174.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -70.07 -40.64 74.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.246 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.5 OUTLIER -68.49 -20.4 64.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.898 177.366 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.659 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.84 -49.26 71.29 Favored 'General case' 0 C--N 1.342 0.28 0 O-C-N 121.815 -0.553 . . . . 0.0 109.559 168.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 10.1 mm-40 -58.7 -50.84 72.38 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.165 176.139 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.512 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -54.12 -36.12 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 117.629 0.195 . . . . 0.0 111.24 178.725 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -70.55 -32.65 70.16 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -68.87 -35.6 77.1 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 110.079 175.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 72.1 mt . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.6 174.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.863 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 19.0 Cg_endo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 113.95 0.712 . . . . 0.0 113.95 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.3 mp0 -45.03 -67.56 0.27 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.389 0.43 . . . . 0.0 111.281 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.718 HD13 ' HB2' ' A' ' 82' ' ' ALA . 9.3 tp -87.68 -11.04 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.84 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.863 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.9 mtp -72.9 -21.44 60.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.957 0.408 . . . . 0.0 110.947 -178.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -86.7 81.14 8.32 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 171.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.628 HD21 HG13 ' A' ' 52' ' ' ILE . 3.8 m-20 -61.75 130.39 45.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.886 -176.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.3 -33.78 69.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.51 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.4 t -62.03 -39.41 92.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 109.956 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -76.13 -31.16 58.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.787 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -67.92 -49.55 61.23 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -48.26 -74.2 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.942 170.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 52.66 35.59 46.32 Favored Glycine 0 C--N 1.344 0.981 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.477 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -73.95 -37.51 64.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 121.053 0.454 . . . . 0.0 110.319 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.476 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.52 104.36 4.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.525 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 53.2 ttm -81.16 -32.29 33.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.241 0.544 . . . . 0.0 109.569 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.8 -33.0 68.1 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.7 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -88.1 -25.01 23.23 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.076 -0.65 . . . . 0.0 111.362 -173.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.45 -34.95 70.71 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -63.68 -48.1 78.55 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.374 0.607 . . . . 0.0 110.205 176.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.4 -47.6 60.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.465 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 2.8 tp10 -69.51 -35.14 75.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.451 0.167 . . . . 0.0 111.349 -173.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.662 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 3.9 mm? -77.31 -22.19 52.32 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 120.939 0.4 . . . . 0.0 110.423 176.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.1 m 58.55 41.52 22.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.53 -169.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CB ' ' A' ' 23' ' ' LEU . 55.9 mt -65.68 139.43 97.03 Favored Pre-proline 0 CA--C 1.516 -0.342 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.861 -172.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.577 ' HG2' HG23 ' A' ' 29' ' ' VAL . 75.1 Cg_endo -82.24 163.64 17.37 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.734 2.289 . . . . 0.0 110.259 170.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.82 -33.44 75.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.757 0.313 . . . . 0.0 111.17 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.2 p -67.89 -47.36 69.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 -178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.577 HG23 ' HG2' ' A' ' 26' ' ' PRO . 65.1 t -73.43 -46.94 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.377 -173.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.51 -32.2 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 118.743 0.701 . . . . 0.0 110.634 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.44 -52.01 37.45 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.806 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -66.84 -33.92 76.67 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.6 tp -49.43 -53.98 19.95 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.931 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -65.58 11.89 0.06 Allowed 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.75 98.91 0.21 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.813 1.642 . . . . 0.0 109.789 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -73.5 -20.83 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.129 -174.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -76.76 147.41 37.31 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -76.08 67.52 2.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.863 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.653 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 3.1 t70 -43.44 -52.23 6.14 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.601 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 26.9 t70 73.19 20.41 3.34 Favored 'General case' 0 C--N 1.355 0.842 0 CA-C-O 122.243 1.021 . . . . 0.0 109.583 -177.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.653 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -85.17 177.97 7.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.359 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.8 t -89.84 126.69 42.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.942 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.8 ttm -71.66 103.43 3.04 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.28 -40.95 17.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.18 -172.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.485 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.0 t70 -89.06 116.63 27.47 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.771 0.796 . . . . 0.0 110.316 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.734 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -54.12 -37.13 64.01 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.901 -1.499 . . . . 0.0 112.257 176.239 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.576 HD21 ' HD3' ' A' ' 26' ' ' PRO . 27.9 tp -66.54 -15.25 63.26 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.286 0.565 . . . . 0.0 110.813 -174.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.31 -51.6 8.7 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.807 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.34 -45.76 3.34 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.004 -0.998 . . . . 0.0 114.366 165.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.509 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 4.0 m -62.0 -46.35 89.61 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.621 1.21 . . . . 0.0 110.061 177.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB2' ' HG ' ' A' ' 23' ' ' LEU . . . -80.28 1.74 27.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.006 -175.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 7' ' ' ASN . 1.9 tp -62.54 -26.91 41.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 173.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 62.9 t30 -147.32 86.07 1.61 Allowed 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.394 174.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.435 ' HB3' HD21 ' A' ' 23' ' ' LEU . 16.3 p -101.75 -45.28 5.28 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.524 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.523 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 mt -70.24 -44.48 68.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 0.0 111.49 -173.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.414 ' HB3' ' OD1' ' A' ' 53' ' ' ASN . . . -80.67 -13.2 59.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 -175.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.595 ' HA ' HG11 ' A' ' 61' ' ' VAL . 98.9 m -83.09 -36.75 24.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.164 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.439 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 25.0 mtpp -71.52 -21.43 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.56 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 53.4 mt -65.35 -65.67 0.64 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.373 175.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -175.45 113.11 0.13 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.314 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.595 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.0 p -175.38 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.594 0.712 . . . . 0.0 111.408 -177.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.705 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.4 m -103.66 120.9 54.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 120.888 -1.132 . . . . 0.0 111.088 -177.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.33 -56.18 5.51 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.74 177.018 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.0 Cg_endo -97.06 -139.21 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.228 2.619 . . . . 0.0 112.761 -171.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.421 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 65.0 m-20 -75.67 11.94 1.19 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.404 -173.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.32 -71.6 0.5 Allowed Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -174.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.619 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p-10 -77.51 156.03 31.26 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.824 -0.688 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.75 41.39 1.21 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.382 0.611 . . . . 0.0 111.833 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.705 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 5.5 p80 -78.25 80.11 4.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.15 177.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -86.88 -62.59 1.47 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.055 -178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.07 -54.75 35.43 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.685 -177.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -56.08 -34.66 66.18 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.626 0.251 . . . . 0.0 111.347 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.531 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -66.91 -35.78 80.78 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.246 0.545 . . . . 0.0 111.006 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.57 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.5 mmmt -79.79 -40.01 29.58 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.316 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.59 -39.73 94.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.812 0.339 . . . . 0.0 110.276 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -57.88 -40.85 81.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.541 175.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.04 78.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.716 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.57 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 56.2 mtt -69.93 -39.45 76.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.001 0.429 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -89.08 -9.34 51.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.96 0.409 . . . . 0.0 110.556 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -143.69 91.24 2.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.411 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 118.3 -76.43 0.29 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.565 175.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.718 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.04 137.02 33.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.653 0.264 . . . . 0.0 110.697 -176.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -79.2 154.96 28.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 121.369 0.604 . . . . 0.0 109.762 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -63.39 -43.83 96.46 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.985 -167.162 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.572 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 2.8 m -51.57 -45.68 63.19 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.863 174.331 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 2.7 ptm -76.32 -39.33 54.35 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.413 0.625 . . . . 0.0 109.419 -177.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -61.03 -36.38 79.38 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.02 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.734 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.7 mp0 -70.8 -25.27 62.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.976 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.4 mm-40 -78.08 -24.46 47.63 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.528 ' O ' HG13 ' A' ' 94' ' ' ILE . 23.4 tp -87.23 -46.16 9.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.683 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' A' ' 88' ' ' GLN . 5.2 m -60.89 -28.51 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -44.17 93.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.65 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.8 mp -67.52 -41.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.118 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 90' ' ' LEU . 54.5 mt -57.5 -46.95 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.247 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -70.14 -33.85 72.32 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.418 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -54.93 3.23 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.151 -1.023 . . . . 0.0 112.263 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.0 m -72.97 -31.39 64.5 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.434 ' HB2' HG11 ' A' ' 114' ' ' VAL . 42.3 tt0 -68.13 -36.39 79.63 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.456 1.025 . . . . 0.0 110.789 171.156 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' A' ' 99' ' ' LYS . 23.9 ttpp -64.27 -43.21 95.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.918 0.39 . . . . 0.0 110.858 177.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 m -104.1 25.53 9.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.25 155.42 92.36 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.297 178.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 50.8 Cg_exo -53.7 155.23 14.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.594 2.196 . . . . 0.0 111.699 176.373 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 15.1 Cg_exo -70.22 24.64 0.19 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.232 2.621 . . . . 0.0 113.191 -177.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 102' ' ' PRO . 85.2 m-20 -105.4 93.37 4.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -79.5 95.43 5.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.816 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.3 t0 -105.56 120.39 41.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.077 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -29.03 -73.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 O-C-N 125.312 1.633 . . . . 0.0 113.689 -176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.488 ' O ' HG22 ' A' ' 111' ' ' THR . 18.0 t -97.68 -7.26 31.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.816 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.4 ttt -82.56 -28.2 31.1 Favored 'General case' 0 C--O 1.251 1.134 0 O-C-N 121.417 -0.802 . . . . 0.0 113.005 -168.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.662 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.2 OUTLIER -56.94 -45.15 82.96 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.929 0.871 . . . . 0.0 110.736 -173.125 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.662 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.6 t -58.87 -10.59 2.53 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 0.0 113.126 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.807 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -91.5 -39.56 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -58.23 -38.87 77.7 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.222 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.654 HG22 ' HA ' ' A' ' 111' ' ' THR . 6.3 m -84.88 -31.38 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 CA-C-O 121.416 0.627 . . . . 0.0 110.041 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.12 -46.35 90.93 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.246 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.557 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.3 ptt? -67.95 -20.45 65.06 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.111 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.917 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 21.4 t -68.69 -30.26 68.89 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.482 0.658 . . . . 0.0 109.263 174.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.65 ' HA ' HG12 ' A' ' 93' ' ' ILE . 71.6 t80 -77.16 -49.37 15.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.298 -178.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.516 ' C ' ' HE3' ' A' ' 119' ' ' LYS 0.254 0.0 OUTLIER -70.96 -16.55 62.66 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.072 177.757 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.917 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -62.26 -54.38 41.61 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.303 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -58.72 -48.96 79.36 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.343 174.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -33.99 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 122.002 -0.436 . . . . 0.0 111.326 178.302 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -71.98 -31.61 66.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.96 -0.463 . . . . 0.0 111.767 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -66.6 -37.44 84.9 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.924 0.392 . . . . 0.0 110.527 175.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 70.2 mt . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.848 172.32 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.649 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 13.0 Cg_endo . . . . . 0 CA--C 1.529 0.256 0 N-CA-C 112.8 0.269 . . . . 0.0 112.8 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.04 -69.7 0.12 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.127 174.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 tp -73.91 -13.43 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 110.926 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.649 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.3 ttt -72.39 -29.97 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.059 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -81.52 96.84 7.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.44 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.461 HD21 HG23 ' A' ' 52' ' ' ILE . 25.8 t-20 -66.55 128.46 36.3 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.499 HD11 ' O ' ' A' ' 80' ' ' HIS . 22.2 mt -54.94 -45.64 74.88 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -176.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -66.12 -35.51 80.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.453 0.168 . . . . 0.0 110.914 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -70.45 -36.68 74.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.136 0.493 . . . . 0.0 110.482 177.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -67.3 -55.36 14.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.907 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 31.2 m-85 -50.41 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.49 -0.777 . . . . 0.0 113.036 173.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.06 35.69 54.78 Favored Glycine 0 C--N 1.342 0.911 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.188 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 9.0 tmtt? -85.44 -36.81 20.39 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.985 0.422 . . . . 0.0 110.155 -176.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.55 88.38 2.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.28 0.562 . . . . 0.0 110.873 -176.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.6 mtm -82.53 -45.62 14.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.051 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -60.24 -44.61 95.1 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.119 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 3.7 mm100 -87.23 -21.05 26.08 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.279 -171.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -75.72 -31.9 59.83 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 170.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 25' ' ' LEU . 27.5 tptp -57.8 -55.39 35.51 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.49 178.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -73.85 -39.57 63.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.09 -177.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 19.1 tt0 -70.35 -32.73 70.56 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -172.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.485 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -83.8 -1.16 53.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.019 0.438 . . . . 0.0 110.08 178.892 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t 63.81 29.06 14.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.901 -177.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.669 HD21 ' HB2' ' A' ' 51' ' ' ALA . 21.3 mt -70.62 128.34 91.11 Favored Pre-proline 0 N--CA 1.45 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.521 -172.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 57.6 Cg_endo -79.76 151.92 22.11 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 121.798 1.666 . . . . 0.0 108.847 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -31.83 66.31 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.871 -176.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 p -65.06 -52.81 53.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.653 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.571 HG23 ' HG2' ' A' ' 26' ' ' PRO . 90.0 t -69.5 -50.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -175.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.556 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.6 p -61.18 -32.75 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.827 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.05 -46.67 50.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.953 0.406 . . . . 0.0 111.12 177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.28 -38.25 88.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.182 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.578 HD13 ' HB1' ' A' ' 48' ' ' ALA . 23.4 tp -55.7 -56.86 15.47 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.855 171.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -68.59 11.64 0.17 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -52.12 125.44 15.68 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 120.24 1.382 . . . . 0.0 110.223 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -70.21 -33.68 71.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.631 -175.144 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -90.5 142.91 27.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.561 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -75.8 78.21 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.42 0.629 . . . . 0.0 110.918 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -42.83 -46.72 5.36 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.759 173.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 70.42 32.25 2.78 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.835 0.826 . . . . 0.0 110.112 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.28 175.69 9.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.836 175.579 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.0 t -90.95 127.3 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 169.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.9 ttm -69.31 94.38 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.181 0.515 . . . . 0.0 109.797 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 p -85.01 -36.26 21.4 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.141 -174.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.542 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.8 t70 -87.04 117.0 25.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.754 0.788 . . . . 0.0 110.597 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.63 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.39 -37.5 62.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.354 175.612 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.664 HD21 ' HD3' ' A' ' 26' ' ' PRO . 33.4 tp -68.92 -14.87 63.3 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.234 0.54 . . . . 0.0 111.013 -172.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.578 ' HB1' HD13 ' A' ' 33' ' ' LEU . . . -76.74 -54.83 6.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.94 -47.17 1.85 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.505 166.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 5.9 m -63.16 -45.02 93.83 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.242 1.021 . . . . 0.0 110.645 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.669 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -72.34 -11.41 60.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.276 -176.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.461 HG23 HD21 ' A' ' 7' ' ' ASN . 67.6 mt -58.67 -39.03 74.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 109.846 173.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.58 84.81 2.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.597 0.713 . . . . 0.0 110.425 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -116.32 -48.26 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.751 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.32 -48.29 23.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 111.484 -172.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HB1' ' HZ ' ' A' ' 76' ' ' PHE . . . -81.01 -15.61 55.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.366 0.603 . . . . 0.0 109.958 -174.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.783 HG23 HG11 ' A' ' 61' ' ' VAL . 55.4 m -80.71 -35.89 32.91 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.267 174.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -71.8 -22.46 61.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -63.67 -64.04 1.01 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.059 175.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -175.24 119.86 0.19 Allowed 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.783 HG11 HG23 ' A' ' 57' ' ' THR . 10.4 p -171.11 32.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.645 0.736 . . . . 0.0 111.096 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.627 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 1.3 m -108.12 122.08 62.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.037 -1.04 . . . . 0.0 111.2 -175.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -53.58 2.77 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.013 177.116 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.649 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 22.7 Cg_endo -99.72 -139.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.08 2.52 . . . . 0.0 113.326 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.5 t70 -72.9 10.67 0.83 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.477 -173.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.75 -67.84 0.55 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.203 -0.998 . . . . 0.0 111.523 -173.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.649 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.0 p30 -82.37 154.93 24.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.95 -0.625 . . . . 0.0 111.243 -178.247 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 69.32 38.57 1.82 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.228 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.627 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 14.3 p80 -75.78 81.06 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.371 0.605 . . . . 0.0 111.233 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -86.41 -61.67 1.69 Allowed 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.744 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.97 -56.37 25.11 Favored Glycine 0 CA--C 1.508 -0.378 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.79 -175.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -55.49 -29.63 59.14 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 123.712 0.301 . . . . 0.0 111.44 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.565 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.74 -36.51 65.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.36 0.6 . . . . 0.0 111.235 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.588 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.2 mmmt -79.18 -39.8 32.46 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . 0.439 ' O ' ' HD2' ' A' ' 79' ' ' LYS . 21.4 t70 -60.7 -41.02 94.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.976 174.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HZ ' ' HB1' ' A' ' 56' ' ' ALA . 54.3 t80 -56.44 -42.78 78.68 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.084 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.37 -25.19 63.15 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.483 -0.487 . . . . 0.0 111.264 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.588 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 48.4 mtt -68.39 -39.48 81.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.357 178.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HD2' ' O ' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -93.41 -7.84 43.46 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.466 178.001 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.499 ' O ' HD11 ' A' ' 8' ' ' LEU . 46.0 m80 -134.71 89.21 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.711 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 123.32 -68.65 0.47 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.329 -0.939 . . . . 0.0 112.9 171.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.1 150.48 20.79 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.032 0.444 . . . . 0.0 111.478 -175.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.63 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 5.5 m-20 -76.66 151.22 36.24 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.11 -32.69 69.34 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.151 -168.06 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.26 -28.63 65.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.848 174.441 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 20.1 mtm -88.24 -41.59 12.84 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.592 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.82 -39.24 80.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.442 171.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.516 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -74.85 -27.16 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 122.642 0.377 . . . . 0.0 111.776 -175.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 4.0 pt20 -80.99 -22.81 39.18 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.589 172.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -83.42 -42.19 17.25 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.911 -179.149 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.6 m -57.59 -32.47 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -45.12 95.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.158 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.622 HG23 ' SG ' ' A' ' 117' ' ' CYS . 3.3 mm -65.84 -44.16 92.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.53 174.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.5 mt -52.72 -47.8 50.04 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.771 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -70.19 -34.75 73.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.424 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.52 -52.36 3.98 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.59 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.6 m -72.29 -32.19 66.39 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.924 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.543 ' HB2' HG11 ' A' ' 114' ' ' VAL . 34.0 tt0 -67.86 -38.41 83.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.959 0.8 . . . . 0.0 110.411 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.62 -43.54 89.24 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.941 0.4 . . . . 0.0 110.49 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -96.01 16.99 16.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.046 -176.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.39 151.42 91.93 Favored Pre-proline 0 C--N 1.325 -0.48 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.445 ' C ' ' H ' ' A' ' 104' ' ' ASN . 52.5 Cg_exo -53.51 156.64 10.85 Favored 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 122.779 2.319 . . . . 0.0 112.156 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.07 24.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.062 2.508 . . . . 0.0 113.265 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 102' ' ' PRO . 67.5 m-20 -90.17 93.91 9.55 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -80.94 96.55 7.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.05 -177.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.916 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 11.9 t70 -122.32 105.87 10.58 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -29.26 -58.49 0.15 Allowed 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.954 1.409 . . . . 0.0 114.116 -177.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.8 t -93.98 -12.69 28.16 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.89 -0.506 . . . . 0.0 112.246 -173.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.916 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.3 ttt -85.7 -27.62 25.19 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.777 0.799 . . . . 0.0 111.617 -169.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.14 -39.15 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.257 -177.433 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -16.82 9.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.685 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.588 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.8 mp -87.73 -36.0 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.86 -36.2 74.22 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.781 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.543 HG11 ' HB2' ' A' ' 98' ' ' GLU . 8.5 m -80.21 -38.35 18.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 O-C-N 121.919 -0.488 . . . . 0.0 110.758 177.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.89 -46.92 88.71 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.864 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.797 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.18 -21.02 60.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.775 178.219 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.622 ' SG ' HG23 ' A' ' 93' ' ' ILE . 11.2 t -66.92 -28.68 68.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 0.0 109.804 171.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -81.04 -48.16 12.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.916 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.797 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.1 -29.25 66.17 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 118.473 -1.291 . . . . 0.0 110.404 -179.873 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 116' ' ' MET . 11.0 ttmt -55.4 -54.85 38.63 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.24 170.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 19.9 mm-40 -57.76 -51.59 68.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.609 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.8 tt -59.33 -33.16 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 118.034 0.379 . . . . 0.0 111.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -71.96 -30.72 65.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.314 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -74.13 -35.84 64.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.072 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.626 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 96.9 Cg_endo . . . . . 0 N--CA 1.462 -0.351 0 N-CA-C 113.206 0.425 . . . . 0.0 113.206 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -50.11 -69.2 0.12 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.622 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.6 tp -73.45 -10.89 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.38 0.609 . . . . 0.0 111.101 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.626 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 77.0 mtp -79.31 -21.71 45.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.552 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -81.1 80.98 7.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.203 0.525 . . . . 0.0 109.601 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -62.12 134.09 56.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.356 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.0 mp -54.9 -45.86 74.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.807 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -63.9 -32.63 74.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.84 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -74.98 -35.97 62.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.147 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.93 -45.91 69.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.02 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -46.76 -77.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.565 170.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.09 38.66 32.53 Favored Glycine 0 C--N 1.342 0.884 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.173 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -63.81 -55.56 22.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.021 0.439 . . . . 0.0 110.613 -177.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.5 105.37 4.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -70.52 -37.15 74.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.711 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.74 -28.74 69.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.511 -178.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 17.8 mm-40 -88.66 -27.18 21.44 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.226 -173.449 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 t -74.51 -35.02 63.17 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 1.026 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -59.32 -51.28 70.63 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.425 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -73.76 -32.31 63.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.406 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -68.16 -44.82 75.1 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.633 0.254 . . . . 0.0 110.844 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.687 ' HB2' HD22 ' A' ' 25' ' ' LEU . 10.5 mt -83.43 -17.29 42.65 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.042 0.449 . . . . 0.0 110.677 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.0 t 66.05 37.97 5.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.587 -177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 1.026 HD23 ' HA ' ' A' ' 20' ' ' LYS . 2.2 mm? -51.04 135.75 28.72 Favored Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.139 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.9 Cg_exo -65.28 149.65 88.25 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.909 1.739 . . . . 0.0 109.504 166.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -60.13 -32.66 71.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.673 0.273 . . . . 0.0 111.017 -174.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 t -70.01 -40.54 75.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.907 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 43.7 t -71.44 -53.14 21.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.392 -176.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.712 HG21 ' HG2' ' A' ' 20' ' ' LYS . 9.9 p -60.34 -36.51 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.804 -178.014 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.34 -51.52 56.4 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.205 177.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -37.85 88.94 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.229 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.5 tp -54.36 -56.62 16.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.796 173.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -68.97 11.66 0.19 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -59.13 130.55 47.51 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 119.926 1.239 . . . . 0.0 110.12 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -70.34 -35.02 73.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.794 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -84.44 136.98 33.62 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.559 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 3.3 mptp? -85.24 75.21 10.31 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.891 -171.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 17.4 t70 -44.04 -55.38 4.73 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.291 172.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.9 t70 75.28 35.5 0.57 Allowed 'General case' 0 C--N 1.348 0.529 0 CA-C-O 121.899 0.857 . . . . 0.0 110.386 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.483 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -77.67 178.01 7.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.828 175.804 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.9 t -84.61 114.8 25.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 174.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.7 ttm -66.71 102.22 0.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.833 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -99.44 -34.8 10.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.104 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.88 117.32 11.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.928 0.87 . . . . 0.0 110.791 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.712 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -47.94 -36.91 13.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.695 -1.593 . . . . 0.0 112.718 174.439 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 25' ' ' LEU . 3.3 mm? -68.5 -20.25 64.57 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.533 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.68 -55.6 4.72 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.27 -43.15 1.4 Allowed Glycine 0 CA--C 1.534 1.232 0 CA-C-N 115.021 -0.99 . . . . 0.0 114.629 167.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.429 ' HB3' HD13 ' A' ' 23' ' ' LEU . 3.2 m -79.61 -43.96 21.89 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.656 1.228 . . . . 0.0 112.174 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.53 ' HB2' HD11 ' A' ' 25' ' ' LEU . . . -71.08 -23.45 62.12 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 tp -73.12 -25.2 21.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.943 0.401 . . . . 0.0 110.305 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.5 43.63 3.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.24 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.6 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 30.7 p -94.55 -44.51 7.82 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.58 -177.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.409 ' O ' HD23 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.88 -46.86 88.93 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -171.019 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.77 -12.27 59.79 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.228 -174.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.541 HG23 HG11 ' A' ' 61' ' ' VAL . 89.4 m -83.75 -33.83 24.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.482 174.081 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 18.6 mmmt -75.08 -23.93 58.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.636 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.4 mm? -64.96 -65.14 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.054 174.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -177.41 116.68 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 -178.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.541 HG11 HG23 ' A' ' 57' ' ' THR . 12.7 p -167.3 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 122.133 0.968 . . . . 0.0 110.113 -177.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.654 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.3 m -107.59 116.89 52.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.419 -177.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -55.08 5.39 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.301 177.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 1.2 Cg_endo -91.17 -147.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.078 2.519 . . . . 0.0 112.605 -175.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -74.35 2.76 8.61 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -173.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 148.19 -61.35 0.44 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.303 -177.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 16.0 p30 -87.87 164.17 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.509 -178.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.529 ' O ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER 69.07 28.69 4.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 173.171 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.654 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.0 p80 -80.3 67.87 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.809 -0.557 . . . . 0.0 111.648 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -87.57 -48.43 7.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 110.085 176.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.54 -51.98 54.58 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.153 -176.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.42 -32.7 71.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.716 -0.242 . . . . 0.0 111.3 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.476 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -64.88 -36.07 83.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE3' HG12 ' A' ' 91' ' ' VAL . 4.4 mmmp? -79.74 -36.35 37.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.449 178.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.03 -40.96 95.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.345 176.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -63.57 -37.2 86.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.165 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -34.36 73.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.241 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.501 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.8 mtm -74.4 -35.78 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.13 -9.21 46.38 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.52 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.534 ' HB3' HD21 ' A' ' 8' ' ' LEU . 57.1 m-70 -141.07 89.27 2.23 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.687 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.19 -75.12 0.36 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.864 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.96 142.88 28.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.952 0.406 . . . . 0.0 111.63 -174.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.596 ' OD2' HG22 ' A' ' 85' ' ' THR . 2.3 p-10 -77.95 159.54 28.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 170.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -61.81 -42.31 98.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.132 -162.134 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.596 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.6 t -54.13 -27.92 36.45 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.85 177.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.623 ' HA ' ' HG2' ' A' ' 89' ' ' GLN . 75.7 mtp -85.28 -39.58 17.56 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.449 0.642 . . . . 0.0 109.909 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.666 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.78 -31.83 73.03 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.947 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -82.24 -26.39 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.051 -176.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 3.4 pt20 -78.22 -22.89 47.81 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.6 tp -75.01 -47.25 30.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.974 175.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.666 HG13 ' O ' ' A' ' 87' ' ' ALA . 32.0 m -57.9 -35.81 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 120.857 0.361 . . . . 0.0 111.44 -176.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -62.69 -43.93 97.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.521 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.28 -42.71 84.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.19 176.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 90' ' ' LEU . 55.9 mt -56.01 -48.14 79.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.122 0.487 . . . . 0.0 110.457 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.961 -175.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.56 -44.88 6.31 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.052 -172.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.9 m -73.09 -41.7 63.79 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 119.321 -0.371 . . . . 0.0 111.35 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 101' ' ' ALA . 4.0 tt0 -66.38 -29.48 69.66 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.982 173.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -63.71 -39.82 95.25 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.219 0.533 . . . . 0.0 109.951 173.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.7 m -99.58 15.93 24.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.001 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.413 ' HB2' ' HA ' ' A' ' 98' ' ' GLU . . . -77.45 147.73 75.99 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.272 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 70.3 Cg_exo -52.79 151.89 18.63 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.257 2.638 . . . . 0.0 112.606 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 13.9 Cg_exo -70.84 47.1 0.69 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.719 2.946 . . . . 0.0 112.907 -179.024 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -125.57 94.3 4.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.369 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -81.54 96.5 7.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.101 0.476 . . . . 0.0 111.74 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.517 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 11.6 t70 -112.84 113.81 26.06 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 168.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.579 ' HG2' ' H ' ' A' ' 108' ' ' CYS . 0.9 OUTLIER -33.63 -60.55 0.36 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 107' ' ' LYS . 5.9 t -91.19 -12.08 36.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.824 0.738 . . . . 0.0 112.16 -175.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 46' ' ' ARG . 2.9 ttp -81.29 -29.96 34.13 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-O 122.025 0.917 . . . . 0.0 111.525 -171.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.423 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.31 -39.11 78.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.565 -179.783 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -15.81 3.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.508 -1.224 . . . . 0.0 112.428 174.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.53 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -90.69 -38.57 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.3 OUTLIER -58.31 -38.26 76.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.056 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.589 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -80.86 -35.92 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.525 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.31 81.58 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.63 ' HA ' ' HD2' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.52 -19.91 60.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.608 0.718 . . . . 0.0 110.48 178.847 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.711 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 9.0 t -72.74 -26.4 61.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.583 172.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -80.3 -44.0 20.32 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.54 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.63 ' HD2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.48 -28.07 65.76 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.834 179.064 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.711 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -61.32 -50.15 74.11 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 171.132 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 124' ' ' LYS . 0.4 OUTLIER -59.18 -47.91 83.56 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 173.005 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -55.75 -35.7 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 118.18 0.446 . . . . 0.0 111.266 178.176 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -70.9 -32.0 68.82 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.82 0.343 . . . . 0.0 111.01 177.002 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 121' ' ' GLU . 68.3 tttt -66.21 -28.29 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.262 176.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 CA--C 1.536 0.415 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.164 175.783 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.825 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.6 Cg_exo . . . . . 0 N--CA 1.477 0.542 0 N-CA-C 114.377 0.876 . . . . 0.0 114.377 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.8 mp0 -45.68 -69.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.485 0.491 . . . . 0.0 111.341 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.6 tp -87.26 -9.48 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.709 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' MET . . . . . 0.825 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 17.4 tmm? -65.48 -36.17 83.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.923 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 8.8 mtpm? -86.51 97.45 10.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.025 0.44 . . . . 0.0 110.212 177.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -67.36 140.68 57.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.141 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mp -58.82 -38.98 79.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.052 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -58.51 -35.84 72.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.969 0.414 . . . . 0.0 110.805 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -75.39 -33.73 61.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.526 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -68.87 -56.59 7.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.318 176.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -52.19 -77.3 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 176.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.55 36.93 59.52 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.564 -170.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -84.97 -40.45 16.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.048 0.452 . . . . 0.0 110.666 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.48 59.43 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.688 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.1 tpt -70.11 -39.71 75.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.196 0.522 . . . . 0.0 110.263 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -61.2 -30.14 70.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.809 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -88.78 -20.52 24.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.01 -0.676 . . . . 0.0 111.919 -174.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -75.21 -32.55 61.22 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 168.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.972 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 26.2 tptp -61.32 -47.92 83.74 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.443 175.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -72.77 -38.16 67.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.802 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -61.12 -41.71 97.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.895 0.378 . . . . 0.0 110.79 -176.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.485 ' HB3' HD11 ' A' ' 47' ' ' LEU . 12.9 mt -86.6 -10.89 52.95 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.722 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t 57.55 41.68 25.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.55 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.972 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 16.2 mt -51.28 119.82 13.34 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.878 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.7 Cg_exo -72.24 157.94 52.77 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.751 2.301 . . . . 0.0 110.815 171.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.559 ' HA ' HG22 ' A' ' 30' ' ' VAL . 7.7 p-10 -65.17 -27.22 68.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -175.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.1 m -68.82 -39.64 79.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.902 0.382 . . . . 0.0 110.516 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.868 HG21 HD23 ' A' ' 47' ' ' LEU . 58.0 t -72.33 -44.52 63.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 27' ' ' ASP . 11.1 m -59.87 -31.7 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 110.566 175.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.65 -52.12 58.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.948 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -67.34 -36.37 81.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.32 -56.93 13.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.365 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -69.04 10.56 0.28 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -66.27 103.81 1.07 Allowed 'General case' 0 C--N 1.344 0.344 0 CA-C-N 120.108 1.322 . . . . 0.0 110.178 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -71.0 -32.37 69.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.109 -175.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -90.23 101.9 14.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.586 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.501 ' NZ ' ' HB2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -72.64 79.69 1.09 Allowed 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.599 0.714 . . . . 0.0 110.443 179.248 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.81 12.89 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.49 -1.232 . . . . 0.0 114.056 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.0 t70 60.02 70.89 0.6 Allowed 'General case' 0 C--N 1.343 0.321 0 CA-C-N 118.695 0.68 . . . . 0.0 110.176 -168.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -115.52 176.35 5.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.762 177.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.7 t -108.89 121.62 62.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.1 ttm -77.68 100.65 6.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.4 p -94.21 -29.92 14.85 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.165 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -78.0 115.06 17.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.677 0.751 . . . . 0.0 110.13 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.915 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -57.27 -35.2 69.48 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.921 174.527 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.868 HD23 HG21 ' A' ' 29' ' ' VAL . 56.5 tp -64.92 -17.81 64.67 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 120.978 0.418 . . . . 0.0 110.795 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.67 1.8 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.03 -45.66 2.24 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 115.215 -0.902 . . . . 0.0 114.672 166.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 86.7 m -64.33 -42.64 96.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.307 1.053 . . . . 0.0 110.408 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.85 -25.11 67.76 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.646 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.1 mt -73.35 -35.57 46.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.188 0.518 . . . . 0.0 110.164 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -104.75 44.74 1.0 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.431 -175.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t -112.27 -47.95 3.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.94 -52.06 58.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.34 0.59 . . . . 0.0 111.037 -170.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -80.92 -11.58 59.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.273 -173.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.636 ' HA ' HG11 ' A' ' 61' ' ' VAL . 22.5 m -83.36 -35.25 25.28 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.525 175.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -78.1 -17.35 57.04 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.405 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mt -64.91 -66.96 0.48 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.57 172.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -178.29 121.75 0.1 Allowed 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.636 HG11 ' HA ' ' A' ' 57' ' ' THR . 11.9 p -176.63 34.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.906 0.86 . . . . 0.0 111.082 -175.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.536 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 33.6 m -108.52 115.5 49.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 O-C-N 121.158 -0.964 . . . . 0.0 111.422 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.22 -55.84 2.11 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.009 178.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 15.9 Cg_endo -97.47 -140.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.984 2.456 . . . . 0.0 113.165 -171.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.485 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 16.4 m-20 -72.89 6.71 2.41 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.48 -174.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.17 -75.35 0.43 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 5.1 p30 -69.52 153.76 43.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.939 -0.63 . . . . 0.0 111.039 176.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' A' ' 68' ' ' LEU . 4.2 mm? 69.82 32.87 3.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.587 173.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.5 p-80 -73.73 76.28 1.56 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.388 0.613 . . . . 0.0 110.71 171.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -86.39 -59.12 2.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.699 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.7 -52.36 53.52 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.216 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -58.13 -34.4 70.21 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.832 -0.184 . . . . 0.0 111.458 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.601 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -67.83 -36.45 80.37 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.3 0.572 . . . . 0.0 111.184 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.5 mmmt -80.03 -37.66 33.61 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.61 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.28 -40.6 96.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.27 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 51.7 t80 -61.49 -40.56 95.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.45 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.28 73.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.96 0.41 . . . . 0.0 111.179 -178.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 53.0 mtt -74.34 -23.7 59.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.088 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -85.88 -15.49 41.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.732 -176.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -146.89 96.71 2.79 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.076 -176.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.54 -71.47 0.22 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.379 -0.915 . . . . 0.0 112.658 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.736 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.06 139.99 31.33 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.487 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.496 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.3 OUTLIER -84.04 166.18 17.94 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.361 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.46 -25.61 63.26 Favored 'General case' 0 N--CA 1.416 -2.168 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.414 -167.564 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.787 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.6 OUTLIER -73.87 -31.11 63.0 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.121 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 9.3 tpp -78.54 -48.0 16.14 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.82 0.819 . . . . 0.0 108.946 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.582 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -58.73 -36.7 74.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.409 176.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.704 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.14 -25.66 61.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.91 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 85' ' ' THR . 14.2 mm-40 -77.77 -25.3 49.0 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.5 tt -87.89 -43.62 11.66 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.862 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 88' ' ' GLN . 4.8 m -60.9 -27.89 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -66.47 -41.14 89.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.462 0.649 . . . . 0.0 109.861 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.531 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -66.46 -39.34 83.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 176.067 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 90' ' ' LEU . 49.3 mt -57.99 -47.39 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.146 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -69.71 -34.88 74.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.55 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.22 -53.09 3.77 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.058 -1.068 . . . . 0.0 112.515 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.7 m -72.42 -32.18 66.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.539 ' OE2' ' HE2' ' A' ' 110' ' ' LYS . 40.3 tt0 -67.21 -34.72 78.08 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.122 0.874 . . . . 0.0 110.114 173.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -63.67 -41.2 98.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.923 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.1 m -103.06 19.57 19.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.72 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.41 155.7 83.72 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.902 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 71.9 Cg_exo -48.41 135.84 26.01 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.692 2.261 . . . . 0.0 111.636 174.568 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.2 Cg_exo -70.51 49.32 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 123.686 2.924 . . . . 0.0 113.498 -176.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -125.35 94.37 4.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 173.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -81.13 84.96 6.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.087 -171.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.662 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.7 t70 -106.94 133.47 51.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.587 176.136 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -30.05 -75.28 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.712 1.258 . . . . 0.0 113.711 -175.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.915 ' HB2' ' HB2' ' A' ' 46' ' ' ARG . 98.1 m -88.63 -10.29 49.13 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.662 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -69.61 -41.17 76.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 -173.557 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HE2' ' OE2' ' A' ' 98' ' ' GLU . 14.3 ptmt -65.19 -51.0 63.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.778 0.799 . . . . 0.0 110.373 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.538 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -59.56 -14.27 12.49 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.575 174.085 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.59 -36.31 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 177.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -63.42 -35.26 79.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.356 176.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 16.0 m -76.36 -37.08 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.985 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.21 78.5 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.308 0.575 . . . . 0.0 111.367 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.624 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.2 ptt? -69.09 -17.68 63.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.281 178.198 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 31.8 t -73.54 -30.03 62.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.835 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -77.64 -43.23 32.12 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.585 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.578 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -70.42 -23.42 62.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.903 176.576 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.624 ' HE3' ' O ' ' A' ' 116' ' ' MET . 1.1 ttmt -62.23 -48.29 80.63 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 121.353 -0.842 . . . . 0.0 110.095 170.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -59.14 -45.0 92.09 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 119' ' ' LYS . 11.8 tt -58.92 -33.41 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-N 118.799 0.727 . . . . 0.0 110.675 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' HIS . . . . . 0.47 ' CE1' ' HD3' ' A' ' 119' ' ' LYS . 1.2 m80 -71.1 -31.43 67.79 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.448 174.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -66.39 -35.28 79.93 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.527 0.331 . . . . 0.0 111.552 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 122' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo . . . . . 0 N--CA 1.462 -0.366 0 CA-C-O 120.683 0.201 . . . . 0.0 112.402 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -45.17 -68.11 0.23 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.173 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.0 tt -83.14 -9.62 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-O 121.002 0.429 . . . . 0.0 111.433 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.2 mmm -66.64 -26.02 66.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.203 0.525 . . . . 0.0 109.799 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -92.93 102.47 14.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.234 166.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -62.92 130.05 43.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 110.888 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 89.6 mt -65.18 -45.04 86.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.598 -176.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 m -60.5 -40.57 91.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.769 0.319 . . . . 0.0 110.771 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -75.89 -24.25 55.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.083 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -73.43 -50.79 19.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 34.9 m-85 -50.24 -77.99 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.353 173.429 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.44 38.52 62.89 Favored Glycine 0 C--N 1.343 0.954 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.717 -177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -68.12 -36.79 80.29 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 117.295 0.547 . . . . 0.0 110.512 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.29 101.52 3.13 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.629 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 50.9 ttm -70.15 -34.43 73.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.105 0.479 . . . . 0.0 109.805 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.35 -38.73 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.279 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -88.29 -25.99 22.51 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.644 -172.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t -75.53 -35.5 60.71 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -47.94 81.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.883 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.73 -37.31 41.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.832 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.52 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 33.9 tp10 -61.45 -41.47 97.26 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.348 0.118 . . . . 0.0 111.025 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 mm? -79.05 -22.48 45.3 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.325 172.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.2 m 58.44 50.54 9.23 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -170.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.642 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 25.4 mt -66.56 121.5 77.49 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.969 -171.422 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' CG2' ' A' ' 29' ' ' VAL . 11.8 Cg_exo -73.3 154.82 51.5 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.558 2.172 . . . . 0.0 110.841 171.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.638 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.0 p-10 -63.54 -23.6 67.46 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 m -65.79 -39.05 90.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.423 0.63 . . . . 0.0 109.85 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.557 ' CG2' ' HD2' ' A' ' 26' ' ' PRO . 58.9 t -70.57 -51.79 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.483 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.638 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.9 m -57.68 -30.51 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.167 0.508 . . . . 0.0 110.731 179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.86 -52.23 57.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.63 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.71 -35.68 65.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.804 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 19.3 tp -50.53 -55.46 15.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.793 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.418 ' HD1' ' O ' ' A' ' 30' ' ' VAL . 20.4 m-85 -77.41 11.45 1.97 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -175.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -58.85 111.39 1.27 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 118.28 0.491 . . . . 0.0 109.873 176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -79.05 -17.33 55.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.513 -171.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -91.03 124.71 35.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.633 0.254 . . . . 0.0 110.897 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -75.96 65.46 2.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.736 179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.718 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 36.5 t70 -54.89 -19.09 5.84 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.771 1.767 . . . . 0.0 115.771 178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.9 t70 62.63 70.61 0.55 Allowed 'General case' 0 C--N 1.348 0.517 0 CA-C-N 119.717 1.144 . . . . 0.0 109.59 -169.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.0 p90 -114.75 165.77 12.46 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.375 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.32 117.31 31.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.5 ttm -75.1 102.05 4.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.364 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -107.43 -16.69 14.31 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -77.98 130.94 37.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.479 . . . . 0.0 110.289 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.884 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 3.4 mpt_? -69.99 -27.07 64.41 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.297 -171.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.7 mm? -80.42 -15.73 56.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.053 -173.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.412 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.34 -61.12 2.03 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.0 -47.69 1.92 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.073 168.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 m -70.79 -42.5 70.26 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.448 1.124 . . . . 0.0 112.042 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.19 -6.28 38.33 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -177.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 48' ' ' ALA . 45.3 mm -57.02 -30.22 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.142 0.496 . . . . 0.0 110.151 172.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -145.49 86.14 1.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.162 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' CYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.0 p -112.72 -47.93 3.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -177.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 52.7 tp -64.53 -55.41 20.74 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.076 0.465 . . . . 0.0 112.083 -170.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.29 -13.79 58.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.958 0.408 . . . . 0.0 110.268 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.617 HG23 HG11 ' A' ' 61' ' ' VAL . 30.5 m -74.54 -34.85 63.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.493 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.52 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 17.5 mmmt -81.17 -24.72 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.222 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 66.5 mt -64.74 -61.81 1.96 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.135 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -175.09 112.78 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.545 0.212 . . . . 0.0 110.802 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.617 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -170.3 32.24 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 121.969 0.89 . . . . 0.0 110.091 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.548 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 19.2 m -105.25 120.49 56.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 O-C-N 121.808 -0.557 . . . . 0.0 110.926 -175.192 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.404 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 1.9 t0 -75.39 -55.51 2.12 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.674 175.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' PRO . . . . . 0.665 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.5 Cg_endo -97.26 -143.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 123.112 2.541 . . . . 0.0 113.071 -172.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 7.6 t70 -72.22 -1.34 14.78 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.593 -175.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 144.14 -68.84 0.42 Allowed Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.164 -0.774 . . . . 0.0 111.164 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.665 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.5 p30 -75.35 149.76 38.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.885 -0.657 . . . . 0.0 111.202 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.28 37.66 2.03 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.017 172.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.585 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.3 p80 -72.6 80.63 1.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.304 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 28.6 p-80 -87.39 -59.82 2.14 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.8 -63.48 4.58 Favored Glycine 0 N--CA 1.462 0.368 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.296 -170.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -57.47 -24.62 56.85 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -177.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -74.37 -36.07 63.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.435 0.636 . . . . 0.0 111.144 178.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.634 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.1 mmmt -79.48 -33.63 42.06 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.71 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.578 172.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 87.7 t80 -57.28 -37.11 71.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.354 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.89 75.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.858 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 54.1 mtt -66.86 -36.24 81.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.901 -175.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -87.63 -14.92 38.73 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.111 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -136.65 89.57 2.47 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.021 -175.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.1 -62.04 0.3 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.077 -1.058 . . . . 0.0 112.361 171.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.95 132.16 35.98 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 121.134 0.492 . . . . 0.0 110.833 -177.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.76 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 91.5 m-20 -75.01 149.42 39.27 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.97 -33.52 64.87 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.884 -174.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.39 -26.4 60.08 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 122.344 -0.223 . . . . 0.0 110.94 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' MET . . . . . 0.76 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 17.9 mtm -86.38 -38.48 17.36 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -174.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . 0.509 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -63.73 -42.6 97.88 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.883 175.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.489 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -75.58 -25.61 57.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -176.123 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.97 -23.89 44.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.607 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' ILE . 60.0 tp -86.51 -48.17 8.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.244 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.489 HG22 ' HA ' ' A' ' 88' ' ' GLN . 16.8 m -57.69 -36.34 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.307 -174.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.02 -42.05 97.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.974 0.416 . . . . 0.0 110.091 -177.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.774 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mm -65.79 -42.34 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.896 175.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.502 HG13 ' O ' ' A' ' 90' ' ' LEU . 58.5 mt -55.43 -47.42 78.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.965 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -70.06 -34.29 73.03 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.439 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -44.07 7.06 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.301 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 0.782 ' HB2' HG12 ' A' ' 114' ' ' VAL . 68.6 m -72.56 -34.4 67.46 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.539 ' HG3' HG11 ' A' ' 114' ' ' VAL . 8.3 mt-10 -64.52 -37.54 87.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.436 0.562 . . . . 0.0 111.069 170.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -67.38 -41.88 84.32 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.821 0.343 . . . . 0.0 110.512 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.4 m -94.68 14.41 21.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.924 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -80.76 150.43 69.44 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.91 159.94 50.97 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 122.606 2.204 . . . . 0.0 110.567 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.12 84.77 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.337 2.024 . . . . 0.0 111.232 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -126.29 108.81 11.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.992 -176.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -83.37 26.69 0.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -169.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.465 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 2.8 p30 -89.73 105.29 17.71 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 122.467 1.127 . . . . 0.0 111.642 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.5 tttp -29.28 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 114.674 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -84.61 -9.97 57.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.659 0.266 . . . . 0.0 111.525 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.884 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 91.7 mmm -85.12 -21.37 29.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -172.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -57.69 -45.31 85.83 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 122.095 0.95 . . . . 0.0 109.975 177.599 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.568 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.38 -12.49 3.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.261 174.227 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.3 mp -89.52 -38.85 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 13.8 m-20 -60.67 -36.94 79.99 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.767 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' VAL . . . . . 0.782 HG12 ' HB2' ' A' ' 97' ' ' CYS . 10.9 m -76.77 -38.21 29.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.91 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.06 -49.08 77.39 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 121.448 0.642 . . . . 0.0 111.546 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' MET . . . . . 0.692 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.13 -23.46 63.97 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.766 179.034 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 117' ' ' CYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 9.3 t -69.43 -26.74 64.75 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 123.344 0.658 . . . . 0.0 109.529 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -75.3 -46.92 30.43 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.262 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.4 ' HA ' ' HB ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -68.53 -25.63 65.02 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 118.345 -1.342 . . . . 0.0 111.15 178.522 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 120' ' ' LYS . . . . . 0.692 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.37 -56.56 18.75 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 109.878 168.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . 0.483 ' HG3' HD11 ' A' ' 93' ' ' ILE . 20.4 mm-40 -59.94 -42.73 94.66 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.507 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.4 ' HB ' ' HA ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -56.52 -34.19 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 118.126 0.421 . . . . 0.0 111.351 177.235 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -31.93 66.34 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.088 -0.383 . . . . 0.0 111.39 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -69.53 -30.54 68.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.269 0.556 . . . . 0.0 110.419 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 97.8 mt . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.202 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.8 p . . . . . 0 N--CA 1.481 1.109 0 CA-C-O 120.371 0.129 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.651 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.9 Cg_endo -65.65 -21.28 59.26 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.817 2.345 . . . . 0.0 112.855 -177.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.01 -69.07 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.568 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.46 HD12 ' HA ' ' A' ' 4' ' ' ILE . 6.6 tp -80.61 -9.71 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 121.132 0.491 . . . . 0.0 111.638 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.651 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 78.4 mtp -73.98 -21.18 60.09 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.47 176.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -74.1 91.68 2.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -73.04 131.84 42.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.52 -174.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 71.6 mt -55.99 -47.49 77.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.124 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.624 ' HB3' HD23 ' A' ' 55' ' ' LEU . 49.2 m -61.89 -29.97 70.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.438 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -75.27 -36.04 61.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.422 . . . . 0.0 110.295 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -68.71 -52.65 28.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.985 178.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -51.41 -78.01 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 173.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 55.5 35.49 61.74 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.631 -175.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -75.65 -41.17 54.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.071 0.436 . . . . 0.0 111.42 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.91 99.36 3.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.861 0.362 . . . . 0.0 111.227 -173.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.33 -46.68 14.35 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.255 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.07 -30.74 71.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.948 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -87.82 -21.99 24.74 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.727 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.2 t -75.21 -34.97 61.53 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 167.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.793 ' HA ' HD13 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -61.16 -45.58 94.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.897 178.834 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -71.16 -40.37 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.788 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.632 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 30.6 tp10 -60.09 -44.07 95.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.373 -0.131 . . . . 0.0 111.042 -173.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.726 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.4 mt -88.44 -8.58 54.7 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.496 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.5 m 57.68 37.57 27.36 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.133 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.793 HD13 ' HA ' ' A' ' 20' ' ' LYS . 5.0 mp -54.08 121.53 30.62 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.293 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.96 155.4 68.24 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.191 1.927 . . . . 0.0 110.878 172.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.68 -31.98 71.21 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.7 p -63.8 -40.4 96.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.707 0.289 . . . . 0.0 111.444 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.5 t -76.21 -55.73 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.643 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -59.61 -28.79 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.935 0.398 . . . . 0.0 110.865 -176.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.56 -51.43 35.49 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.29 -35.98 82.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.318 0.58 . . . . 0.0 110.031 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -38.62 69.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.395 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -78.54 8.9 4.53 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.473 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 43.7 t30 -65.65 107.74 1.84 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.709 0.686 . . . . 0.0 109.747 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -81.16 -18.38 46.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.227 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.473 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 30.4 m-90 -73.45 131.71 42.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -80.71 53.29 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.125 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.571 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 37.7 t70 -43.73 -42.67 5.55 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 172.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.4 t70 66.36 61.31 0.59 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-O 121.716 0.769 . . . . 0.0 109.929 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.571 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -97.28 177.32 5.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.107 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.2 t -84.29 126.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.74 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 37.5 ttm -67.11 103.46 1.2 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.0 p -101.72 -26.74 13.39 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -173.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 15.3 t70 -101.62 122.51 44.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.69 0.757 . . . . 0.0 112.493 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 1.023 ' HB2' ' HB3' ' A' ' 108' ' ' CYS . 0.1 OUTLIER -47.59 -40.94 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.132 172.432 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.807 HD22 ' HG2' ' A' ' 46' ' ' ARG . 2.9 mm? -65.87 -19.24 65.81 Favored 'General case' 0 C--N 1.333 -0.144 0 O-C-N 122.021 -0.425 . . . . 0.0 111.068 -176.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.08 -61.24 1.96 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -39.12 -48.13 2.65 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 114.688 -1.142 . . . . 0.0 114.504 168.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.5 m -67.31 -41.95 84.51 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.405 1.102 . . . . 0.0 111.674 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -63.24 -23.86 67.61 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.9 mt -58.09 -39.23 71.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.992 0.425 . . . . 0.0 110.946 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.489 ' O ' ' HB ' ' A' ' 57' ' ' THR . 3.7 p-10 -113.84 42.84 1.93 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.481 0.658 . . . . 0.0 110.16 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 10.6 t -98.75 -46.4 5.69 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.656 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 9' ' ' SER . 4.4 mm? -60.31 -55.88 28.24 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 111.963 -174.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.09 -16.62 49.41 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.909 -172.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 53' ' ' ASN . 18.1 m -84.93 -42.37 15.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.372 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.632 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 5.8 mmmt -72.76 -15.97 61.65 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.373 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.84 -65.92 0.61 Allowed 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 172.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -176.28 119.14 0.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.056 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.466 ' CG1' HG23 ' A' ' 57' ' ' THR . 9.2 p -175.62 31.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 121.54 0.686 . . . . 0.0 111.327 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.545 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 32.9 m -93.34 118.72 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 O-C-N 121.147 -0.971 . . . . 0.0 111.401 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.31 -53.27 10.67 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.505 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.681 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -98.99 -143.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 123.345 2.696 . . . . 0.0 112.999 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 6.3 p-10 -72.21 -5.72 37.8 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.633 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 151.41 -60.96 0.41 Allowed Glycine 0 C--N 1.316 -0.572 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.681 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -85.36 165.48 17.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.815 -0.692 . . . . 0.0 109.817 176.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.09 29.79 4.62 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.308 0.575 . . . . 0.0 111.308 171.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.577 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 9.2 p80 -73.4 74.3 1.38 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.192 0.52 . . . . 0.0 111.794 177.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -86.38 -50.86 6.6 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.13 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.4 -61.71 6.58 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.948 -172.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -56.68 -31.08 64.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.67 -37.95 76.89 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.219 0.533 . . . . 0.0 110.968 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -79.73 -35.59 38.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.0 -40.96 95.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.457 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -63.57 -38.78 92.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.663 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.09 78.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.066 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 72.0 mtm -73.63 -23.46 59.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.812 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -93.22 -14.26 27.31 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.935 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -144.99 95.41 2.68 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 120.742 0.306 . . . . 0.0 111.042 -177.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.38 -70.11 0.42 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.236 173.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -103.72 135.4 45.34 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.4 ' OD1' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -80.21 172.56 13.61 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.197 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -23.25 67.16 Favored 'General case' 0 N--CA 1.422 -1.872 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.604 -167.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 1.2 t -73.19 -30.9 63.86 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.481 -177.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.581 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 71.9 mtp -81.93 -41.2 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.376 0.608 . . . . 0.0 109.362 -175.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.583 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -62.29 -33.23 74.25 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.235 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.74 -21.45 51.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.25 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.816 ' HG2' ' O ' ' A' ' 85' ' ' THR . 10.6 mm-40 -77.74 -25.31 49.14 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 172.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.2 mp -85.45 -42.94 14.03 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.604 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.583 HG13 ' O ' ' A' ' 87' ' ' ALA . 29.8 m -56.91 -32.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.86 0.362 . . . . 0.0 111.809 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.17 -44.91 78.52 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.601 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.636 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.5 mp -67.62 -43.75 86.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 50.0 mt -52.67 -48.7 48.16 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.786 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -71.7 -36.54 70.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.196 -174.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.33 -44.4 6.6 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 119.722 -1.228 . . . . 0.0 112.367 -172.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.739 ' HB2' HG12 ' A' ' 114' ' ' VAL . 38.7 m -72.23 -41.11 67.2 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.854 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.501 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.4 tt0 -63.89 -38.79 92.4 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 117.948 0.34 . . . . 0.0 110.798 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -67.14 -34.46 77.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 m -95.79 5.34 51.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.259 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.33 149.44 78.91 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.719 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.474 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 22.7 Cg_exo -65.37 144.53 80.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.731 2.287 . . . . 0.0 111.195 178.009 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 7.9 Cg_exo -73.37 35.52 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.425 2.75 . . . . 0.0 113.314 -175.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -76.77 112.08 12.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -77.75 96.22 4.85 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -167.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.74 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.0 t0 -144.04 100.73 3.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 163.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -40.77 -44.75 2.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' A' ' 46' ' ' ARG . 4.1 t -88.06 -24.58 23.41 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.583 1.083 . . . . 0.0 112.232 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.74 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 75.4 mmm -74.76 -26.39 59.73 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.987 -0.445 . . . . 0.0 111.884 -175.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.556 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -60.14 -43.03 96.04 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.766 0.793 . . . . 0.0 110.032 178.192 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.556 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.03 -14.9 7.46 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.35 174.418 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.565 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.5 mp -89.95 -38.0 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 14.4 t70 -60.06 -34.11 72.97 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.432 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.739 HG12 ' HB2' ' A' ' 97' ' ' CYS . 14.0 m -80.57 -39.47 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.574 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.75 -49.64 76.68 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.323 0.582 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.718 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.84 -24.67 63.49 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.305 178.918 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.4 t -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.171 0.51 . . . . 0.0 110.137 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.568 ' HA ' HG12 ' A' ' 93' ' ' ILE . 73.7 t80 -79.65 -45.87 18.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.123 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -69.27 -28.8 66.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.71 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.718 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.54 -51.06 71.48 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.916 0.389 . . . . 0.0 110.452 170.349 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -57.52 -54.9 41.64 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.67 177.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.14 -32.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 120.699 0.285 . . . . 0.0 111.44 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -71.22 -30.63 66.59 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.625 ' HE2' ' HA ' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.28 -33.07 67.17 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.796 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.36 -40.05 89.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.56 172.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 64.3 t30 49.47 -85.03 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.531 1.133 . . . . 0.0 113.71 172.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -77.79 100.17 6.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.557 0.694 . . . . 0.0 111.656 -174.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.3 p -135.5 103.47 10.3 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.184 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.15 138.02 22.14 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.022 2.481 . . . . 0.0 112.302 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -90.41 151.64 21.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.053 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.94 -7.6 58.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.365 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 67.73 117.58 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.883 0.739 . . . . 0.0 111.593 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp -86.45 65.56 9.1 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.948 -177.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 11.9 m -76.23 107.79 7.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.566 0.698 . . . . 0.0 110.949 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.9 120.06 63.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.778 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -96.56 96.69 1.93 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.578 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -75.37 95.26 3.19 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.6 m -82.36 96.73 3.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.52 0.676 . . . . 0.0 111.505 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -95.22 103.13 14.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -100.61 107.2 18.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.43 . . . . 0.0 110.885 -177.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -77.09 147.64 36.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.47 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.424 ' O ' HG13 ' A' ' 142' ' ' VAL . 11.4 p . . . . . 0 C--O 1.248 0.989 0 O-C-N 124.473 1.108 . . . . 0.0 112.498 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.679 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 18.5 Cg_endo -57.99 -21.91 52.38 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.361 2.707 . . . . 0.0 114.384 -173.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.5 -69.13 0.12 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.72 0.295 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.88 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.2 mm -80.16 -15.08 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-O 121.092 0.472 . . . . 0.0 111.676 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.679 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 13.4 tmm? -64.64 -38.2 90.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.016 0.436 . . . . 0.0 110.267 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -93.45 120.38 33.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.36 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -71.79 133.83 45.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.789 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.604 HD11 ' O ' ' A' ' 80' ' ' HIS . 50.7 mt -57.7 -43.15 84.97 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.035 0.209 . . . . 0.0 110.914 178.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.0 m -61.79 -38.72 89.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.897 0.379 . . . . 0.0 110.763 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -75.47 -34.56 60.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.4 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -67.19 -54.05 24.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.678 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HD2' ' O ' ' A' ' 8' ' ' LEU . 32.9 m-85 -47.45 -73.02 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.459 168.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.01 40.23 58.18 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.306 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.459 ' HD3' ' C ' ' A' ' 14' ' ' LYS . 12.2 tmtt? -67.48 -58.14 5.27 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.1 90.46 1.36 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.684 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 64.6 mtt -71.62 -27.19 62.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.251 0.548 . . . . 0.0 109.773 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 37.3 t70 -62.27 -24.69 67.42 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.799 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -88.13 -25.14 23.14 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.197 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.6 t -76.13 -36.58 58.74 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.76 -42.09 97.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.462 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -71.3 -42.85 68.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.088 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -70.24 -41.46 73.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.352 -174.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' A' ' 25' ' ' LEU . 15.3 mt -83.48 1.17 43.1 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.972 0.415 . . . . 0.0 111.291 -177.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.8 m 67.38 31.92 6.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.721 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' A' ' 23' ' ' LEU . 8.4 mp -62.15 121.4 65.78 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.724 175.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 12.5 Cg_exo -71.07 160.22 49.91 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.89 2.393 . . . . 0.0 111.167 173.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.767 ' HA ' HG22 ' A' ' 30' ' ' VAL . 4.6 p-10 -69.4 -16.42 63.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.34 -176.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 p -64.85 -48.83 72.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 0.0 110.341 174.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.2 t -71.0 -45.82 70.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.256 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.767 HG22 ' HA ' ' A' ' 27' ' ' ASP . 14.9 m -59.28 -30.04 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.975 0.417 . . . . 0.0 110.043 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.54 -52.19 54.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.798 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.02 -36.11 81.38 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.104 0.478 . . . . 0.0 110.202 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -54.99 25.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.177 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -66.95 11.08 0.11 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -64.36 118.27 8.46 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.02 1.282 . . . . 0.0 110.063 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -92.55 -36.33 13.09 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -77.39 151.18 34.94 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.217 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -80.13 60.24 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.951 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -55.49 -36.33 66.52 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.713 171.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.1 t0 59.41 70.92 0.61 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.51 0.671 . . . . 0.0 110.087 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.414 ' HD1' ' O ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.22 164.66 11.57 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.68 -179.283 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.2 t -85.44 115.16 26.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 173.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.617 ' O ' HG21 ' A' ' 112' ' ' ILE . 39.4 ttp -72.49 99.08 2.41 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.028 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.8 p -110.48 -9.99 14.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.839 -175.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -80.41 134.22 35.98 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.851 0.834 . . . . 0.0 110.443 178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.723 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 6.2 mpt_? -72.99 -29.12 62.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.227 -1.352 . . . . 0.0 110.681 -170.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB3' ' HG ' ' A' ' 25' ' ' LEU . 3.3 mm? -76.13 -15.25 60.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.495 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.582 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -84.46 -58.73 2.62 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.8 -47.53 1.8 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.187 -0.915 . . . . 0.0 114.096 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.423 ' HB3' HD13 ' A' ' 23' ' ' LEU . 7.3 m -66.55 -43.93 83.72 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.292 1.046 . . . . 0.0 111.641 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.705 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -67.82 -23.97 65.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.87 0.367 . . . . 0.0 111.861 -177.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 48' ' ' ALA . 37.2 mm -65.6 -32.41 58.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.981 0.42 . . . . 0.0 110.835 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 14.5 p30 -132.12 53.7 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.499 -176.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.576 ' SG ' HD12 ' A' ' 55' ' ' LEU . 25.8 p -115.16 -44.05 3.04 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.59 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' SG ' ' A' ' 54' ' ' CYS . 9.0 mp -54.52 -44.0 72.4 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.197 0.523 . . . . 0.0 111.534 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.407 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -79.8 -11.74 59.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.318 -173.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.806 ' HA ' ' CG1' ' A' ' 61' ' ' VAL . 13.2 m -83.63 -33.17 25.35 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.646 0.736 . . . . 0.0 110.211 174.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 13.3 mmmt -71.26 -31.48 67.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.249 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.95 -67.07 0.47 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.72 172.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -178.97 123.21 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.546 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.806 ' CG1' ' HA ' ' A' ' 57' ' ' THR . 7.9 p -177.42 32.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.431 0.634 . . . . 0.0 112.171 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.537 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.1 m -101.34 123.22 54.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.691 -1.256 . . . . 0.0 111.42 -177.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.462 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 12.3 t70 -73.5 -54.29 4.09 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.891 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.74 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 57.0 Cg_endo -104.62 -139.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 123.398 2.732 . . . . 0.0 113.066 -171.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.52 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 18.3 m-20 -73.25 3.0 6.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.673 -175.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.41 -75.47 0.33 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.785 -0.722 . . . . 0.0 111.35 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.685 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p30 -76.53 157.05 32.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.183 -0.508 . . . . 0.0 110.742 177.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 69.49 34.17 2.89 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.585 0.553 . . . . 0.0 111.22 176.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.74 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.7 p80 -73.71 79.98 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.439 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.9 p-80 -87.69 -57.25 3.01 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.424 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.12 -63.08 5.03 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.086 -169.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -59.36 -22.86 61.96 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.435 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -72.7 -33.83 66.74 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.965 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 29.8 mmmt -78.82 -31.62 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.059 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -64.96 -39.97 94.29 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.407 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 88.7 t80 -61.64 -36.89 82.08 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.704 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.17 -40.85 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.828 0.346 . . . . 0.0 110.991 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.563 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 73.9 mtm -75.18 -19.76 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.199 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -90.13 -16.26 29.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.231 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.604 ' O ' HD11 ' A' ' 8' ' ' LEU . 48.9 m80 -143.27 96.34 2.9 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.653 0.263 . . . . 0.0 110.37 -175.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.85 -62.64 0.3 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.125 172.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.88 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.43 139.74 38.93 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.046 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.474 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.7 OUTLIER -82.25 169.02 17.03 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 168.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 12.2 pt-20 -68.09 -22.65 64.9 Favored 'General case' 0 N--CA 1.409 -2.487 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.298 -165.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.474 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.4 t -73.22 -29.43 62.79 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.08 -175.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 61.1 mtm -87.22 -38.82 16.01 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.61 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.21 -37.64 80.93 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.321 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -77.2 -21.85 53.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.275 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -77.23 -22.12 52.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.027 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 94' ' ' ILE . 28.8 tp -88.26 -39.38 14.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.65 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.2 m -57.59 -35.92 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -171.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.71 -38.13 83.18 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.036 -175.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.895 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.5 mp -65.79 -39.59 85.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 171.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.6 mt -58.04 -48.19 84.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.988 -178.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -70.93 -36.4 72.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.517 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.12 -46.09 6.02 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.17 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 93' ' ' ILE . 48.7 m -72.73 -38.27 67.49 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 116.494 0.147 . . . . 0.0 110.919 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.55 -39.3 76.35 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.295 -0.253 . . . . 0.0 110.983 170.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -74.33 -43.01 58.48 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.144 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.1 m -94.57 14.55 20.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.708 -173.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.21 151.39 81.71 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.472 ' C ' ' H ' ' A' ' 104' ' ' ASN . 51.5 Cg_exo -56.63 163.26 7.23 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.924 2.416 . . . . 0.0 112.189 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.92 33.34 0.13 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.482 2.788 . . . . 0.0 113.168 177.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.472 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.4 m-20 -121.81 101.9 7.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -79.56 96.12 6.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.99 0.9 . . . . 0.0 109.546 178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -90.42 104.73 17.27 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.619 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -31.29 -77.26 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 O-C-N 124.824 1.328 . . . . 0.0 113.735 -169.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 42.2 t -95.91 -11.08 27.21 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.826 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 1.9 tmm? -86.89 -16.34 36.3 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 112.613 -169.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.562 ' HG3' ' H ' ' A' ' 111' ' ' THR . 22.5 pttt -55.59 -45.94 77.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.769 0.795 . . . . 0.0 111.068 -173.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.626 HG23 HD12 ' A' ' 112' ' ' ILE . 12.6 t -57.33 -13.73 3.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.426 -1.261 . . . . 0.0 112.843 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -90.45 -37.35 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -58.09 -37.03 73.73 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.687 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -79.42 -36.48 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.38 0.609 . . . . 0.0 110.447 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.19 70.64 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.373 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.698 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 19.5 ptt? -69.59 -17.89 63.58 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.201 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 53.0 t -73.26 -22.36 60.41 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.895 ' HB2' HG21 ' A' ' 93' ' ' ILE . 54.2 t80 -81.0 -46.3 15.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.686 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.29 -17.52 63.09 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 118.309 -1.356 . . . . 0.0 109.397 175.854 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.698 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.47 -55.3 21.67 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.149 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 8.0 mm-40 -58.95 -51.3 70.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.642 175.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.33 -32.9 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 178.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -70.9 -32.8 69.86 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.038 -0.413 . . . . 0.0 112.057 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -73.76 -34.37 64.68 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.441 0.638 . . . . 0.0 109.959 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 79.1 mt -76.16 4.74 8.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.936 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -92.38 126.76 37.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.007 0.432 . . . . 0.0 110.537 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' TRP . . . . . 0.575 ' O ' ' HD3' ' A' ' 129' ' ' PRO . 11.4 p-90 -109.3 179.65 4.09 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.744 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.99 103.3 16.67 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 121.315 0.579 . . . . 0.0 110.925 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.575 ' HD3' ' O ' ' A' ' 127' ' ' TRP . 5.4 Cg_exo -80.21 127.21 6.63 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.874 2.382 . . . . 0.0 111.632 178.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -93.81 3.53 55.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.87 0.843 . . . . 0.0 109.276 178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 23.5 ptp -128.87 158.21 39.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.66 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -146.24 97.22 2.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.885 0.85 . . . . 0.0 110.107 171.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.29 83.23 4.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.536 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 6.4 m -86.16 88.84 2.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.318 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -101.18 124.86 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.797 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 155.38 32.95 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -77.02 109.41 10.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.179 -0.51 . . . . 0.0 110.576 -176.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.0 t -87.02 124.04 40.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 176.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.4 tp -75.57 103.6 5.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.425 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -114.5 81.89 1.63 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.637 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.767 ' HG3' HG23 ' A' ' 142' ' ' VAL . 16.8 pt-20 -99.26 -35.61 9.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.438 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.767 HG23 ' HG3' ' A' ' 141' ' ' GLU . 19.7 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.591 -0.719 . . . . 0.0 109.285 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.52 0.2 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.401 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.4 Cg_endo -65.91 -21.91 56.59 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.52 2.147 . . . . 0.0 112.351 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.29 -66.47 0.39 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.044 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tp -75.36 -15.6 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 121.17 0.51 . . . . 0.0 111.517 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.401 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 73.7 mtp -76.84 -40.61 47.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -80.12 97.05 6.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.91 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -62.38 123.27 17.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.342 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.07 -36.41 77.29 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.286 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 m -60.29 -34.64 74.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -75.0 -32.76 61.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.019 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -67.92 -45.06 75.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.721 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -57.1 -86.5 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 169.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.81 37.91 44.41 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.492 -178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -61.45 -59.31 5.44 Favored 'General case' 0 C--N 1.335 -0.042 0 CA-C-O 121.227 0.536 . . . . 0.0 110.437 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.45 100.55 3.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.965 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.508 ' HG2' ' OH ' ' A' ' 34' ' ' TYR . 17.0 tpt -74.61 -22.3 59.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.759 -178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -53.89 -31.53 50.21 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.473 -175.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 26.3 mt-30 -87.42 -21.33 25.66 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.834 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 32.1 t -75.27 -36.17 61.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 170.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.77 ' HA ' HD23 ' A' ' 25' ' ' LEU . 29.7 tptp -58.27 -51.07 71.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.636 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.13 -47.79 48.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.91 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.519 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 5.8 mm-40 -69.7 -32.28 70.79 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 54' ' ' CYS . 1.5 mm? -90.6 -21.46 21.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 61.91 50.28 4.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.117 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -63.12 125.7 87.48 Favored Pre-proline 0 CA--C 1.52 -0.188 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.959 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.7 Cg_exo -64.68 150.6 87.92 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.696 1.597 . . . . 0.0 109.4 168.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -54.99 -33.82 62.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.909 0.385 . . . . 0.0 111.676 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -78.58 -29.84 46.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.004 -174.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.434 HG11 ' CB ' ' A' ' 47' ' ' LEU . 26.1 t -77.22 -49.44 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 121.101 -0.24 . . . . 0.0 111.303 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.5 p -60.43 -27.36 39.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 121.114 0.483 . . . . 0.0 109.811 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.91 -52.02 33.77 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.699 173.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -63.65 -33.29 75.29 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.321 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.1 tp -51.02 -55.46 17.36 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.722 170.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.508 ' OH ' ' HG2' ' A' ' 16' ' ' MET . 18.4 m-85 -68.51 12.15 0.14 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 176.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.56 123.33 16.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 119.859 1.208 . . . . 0.0 110.419 -173.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -72.26 -36.24 68.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.719 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.2 m-90 -92.9 101.82 14.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.245 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -76.37 78.17 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.186 0.517 . . . . 0.0 109.896 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.549 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 34.5 t70 -62.51 12.1 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.0 t0 53.81 43.05 31.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.227 0.921 . . . . 0.0 110.047 -174.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.549 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 13.1 p90 -86.7 175.02 8.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.981 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -95.59 125.63 48.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.463 ' HE1' HD11 ' A' ' 52' ' ' ILE . 42.6 ttm -68.45 103.65 1.71 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.058 0.456 . . . . 0.0 110.251 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.9 p -93.31 -39.47 10.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.842 -174.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -83.57 134.56 34.81 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.924 0.868 . . . . 0.0 111.025 -176.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 4.2 mpt_? -74.98 -30.14 61.09 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.11 -1.404 . . . . 0.0 110.149 -173.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.625 HD12 HD13 ' A' ' 25' ' ' LEU . 3.7 mm? -66.55 -15.23 63.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.796 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.505 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.74 -56.76 3.93 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.582 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.33 -47.29 3.61 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-N 114.933 -1.03 . . . . 0.0 114.58 165.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 20.8 m -66.28 -44.52 83.33 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 118.786 1.293 . . . . 0.0 110.28 -178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.18 -17.3 63.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.553 -175.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 48' ' ' ALA . 71.4 mt -54.37 -37.76 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.083 0.468 . . . . 0.0 110.22 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -143.79 71.96 1.34 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.317 0.58 . . . . 0.0 109.725 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.481 ' HB2' HD21 ' A' ' 23' ' ' LEU . 23.1 p -104.52 -45.93 4.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.385 176.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.4 tp -62.37 -47.28 84.86 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.417 -176.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.84 -16.25 51.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.904 0.383 . . . . 0.0 110.772 -173.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.48 HG23 ' CG1' ' A' ' 61' ' ' VAL . 55.3 m -84.06 -36.93 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.587 174.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 15.6 mmmt -68.31 -25.0 64.9 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.246 -0.284 . . . . 0.0 111.273 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.3 mt -64.49 -66.09 0.59 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 121.098 -0.241 . . . . 0.0 110.934 176.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -176.76 121.83 0.14 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.515 0.198 . . . . 0.0 110.744 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 57' ' ' THR . 13.9 p -173.29 50.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.256 1.027 . . . . 0.0 110.267 -176.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.59 ' HA ' ' HB2' ' A' ' 69' ' ' HIS . 1.5 m -110.1 125.8 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 121.601 -0.687 . . . . 0.0 111.249 -173.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -76.78 -56.14 1.4 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.265 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 16.4 Cg_endo -98.34 -139.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.504 2.803 . . . . 0.0 112.851 -171.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.502 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 28.8 t70 -71.5 -1.5 13.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.512 -177.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.44 -65.57 0.5 Allowed Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.34 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p-10 -76.31 149.57 37.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.549 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 68.6 40.67 1.83 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.318 0.58 . . . . 0.0 111.176 174.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 62' ' ' VAL . 8.3 p80 -74.73 69.54 1.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.511 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 30.1 p-80 -82.22 -50.71 8.69 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.91 -56.16 26.34 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.837 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.68 -27.75 66.68 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.38 -36.71 66.12 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.454 0.645 . . . . 0.0 110.722 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -78.65 -37.85 41.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.68 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 18.9 t70 -66.72 -32.49 73.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.464 173.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -57.69 -42.04 82.88 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.995 0.426 . . . . 0.0 110.126 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 -34.86 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.679 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 72.7 mtm -74.42 -26.49 60.11 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.597 ' HD3' ' CE1' ' A' ' 80' ' ' HIS . 4.8 ptpp? -93.03 -18.47 22.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.714 -0.795 . . . . 0.0 110.933 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.597 ' CE1' ' HD3' ' A' ' 79' ' ' LYS . 6.4 m-70 -134.53 91.44 2.78 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 124.31 -74.52 0.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.705 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -91.74 132.61 36.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.867 0.365 . . . . 0.0 111.315 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.484 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -85.11 173.57 10.36 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -59.59 -34.45 72.75 Favored 'General case' 0 N--CA 1.418 -2.058 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -170.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.795 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 5.2 t -63.61 -31.42 72.59 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.362 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 46.1 mtt -82.5 -39.66 22.14 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -64.23 -37.32 87.07 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.556 177.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.453 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -75.69 -26.17 57.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.502 -175.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 85' ' ' THR . 54.2 mm-40 -80.14 -24.26 40.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.67 172.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 94' ' ' ILE . 42.0 tp -84.15 -46.38 11.97 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.085 -176.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.453 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.2 m -56.88 -36.76 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.869 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.58 -43.53 80.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.437 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.731 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.6 mp -69.11 -43.32 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.245 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.7 mt -55.65 -47.79 78.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.669 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -71.06 -35.16 71.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.698 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.15 -45.25 6.32 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.491 -173.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' A' ' 93' ' ' ILE . 60.1 m -72.65 -37.05 68.09 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.117 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.09 -39.32 93.81 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.282 0.492 . . . . 0.0 110.719 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.92 -34.15 77.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.08 0.467 . . . . 0.0 110.48 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 m -104.09 17.19 24.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.973 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.76 155.97 67.95 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.252 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.06 143.84 91.68 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.968 1.779 . . . . 0.0 110.473 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.55 72.28 0.43 Allowed 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.665 2.243 . . . . 0.0 112.908 -176.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -125.62 95.21 4.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.823 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -76.51 96.31 4.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.191 0.519 . . . . 0.0 111.321 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 1.074 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.2 t70 -143.92 120.34 10.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.756 174.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.566 ' NZ ' ' HB2' ' A' ' 107' ' ' LYS . 3.9 ttmp? -34.68 -60.84 0.42 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 178.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.418 ' O ' HD13 ' A' ' 112' ' ' ILE . 5.9 m -89.51 -10.13 47.42 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . 1.074 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 1.3 tmm? -69.03 -42.97 75.65 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-O 122.214 1.007 . . . . 0.0 110.092 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.591 ' HG3' ' H ' ' A' ' 111' ' ' THR . 14.4 ptpt -64.92 -49.98 68.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.169 -1.378 . . . . 0.0 111.342 -172.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.591 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 11.6 t -57.98 -14.98 7.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.68 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.582 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.5 mp -91.66 -40.71 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 8.5 t70 -61.94 -34.91 76.96 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.078 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.662 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.1 m -81.53 -37.38 15.36 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.865 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.2 -51.78 68.1 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-O 120.817 0.341 . . . . 0.0 111.795 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.651 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.43 -26.02 64.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.015 179.635 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 32.3 t -68.52 -24.76 64.69 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.112 0.482 . . . . 0.0 109.837 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 93' ' ' ILE . 37.8 t80 -77.31 -49.73 14.37 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.845 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -23.65 61.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.824 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.92 -54.43 46.27 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 118.869 0.758 . . . . 0.0 109.367 167.469 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.442 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 6.8 tp10 -58.07 -50.4 73.6 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.87 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.85 -32.89 22.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 117.742 0.246 . . . . 0.0 111.161 177.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.423 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 2.7 m-70 -71.29 -32.88 69.17 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -78.47 -31.26 47.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 0.0 109.862 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 91.4 mt -72.47 11.36 0.63 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.52 175.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 19.4 t-20 -55.87 152.61 9.68 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -73.69 78.02 1.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 122.155 0.978 . . . . 0.0 110.403 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.515 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 30.6 m -120.5 137.63 26.45 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.495 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 2.8 Cg_exo -77.03 114.19 3.76 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 123.06 2.507 . . . . 0.0 111.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.607 ' HB3' ' OD1' ' A' ' 132' ' ' ASP . 55.8 t30 -95.23 176.76 6.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 22.2 ptp -79.51 7.86 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.651 0.262 . . . . 0.0 111.21 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.607 ' OD1' ' HB3' ' A' ' 130' ' ' ASN . 4.4 p-10 -94.15 127.98 40.29 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 50.0 tp -116.93 122.58 44.7 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.152 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 13.4 m -119.28 111.17 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.154 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 38.9 mm -109.7 100.61 11.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.243 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -80.94 94.52 1.57 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.184 176.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.11 148.04 38.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.884 0.373 . . . . 0.0 110.686 -177.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.2 t -123.14 125.33 71.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.689 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.4 tp -126.58 112.08 15.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.877 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.23 -166.57 1.43 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.239 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.64 148.94 32.28 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.026 0.441 . . . . 0.0 110.35 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.858 178.541 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.487 0.184 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.2 Cg_exo -59.04 -22.1 62.15 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.959 2.439 . . . . 0.0 112.552 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -50.03 -67.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 111.341 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.896 HD11 ' HB2' ' A' ' 82' ' ' ALA . 23.4 mm -76.17 -16.25 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 121.066 0.46 . . . . 0.0 111.326 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.446 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 5.2 tmm? -68.4 -43.62 76.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.517 ' HE3' ' OD1' ' A' ' 11' ' ' ASN . 41.9 tptt -80.73 85.54 6.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.356 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.465 ' OD1' ' HB2' ' A' ' 10' ' ' ASN . 3.0 p30 -62.65 125.55 24.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.218 -175.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.704 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.9 pt? -61.85 -30.2 70.69 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.506 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -61.6 -41.49 97.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.796 0.331 . . . . 0.0 110.855 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.465 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m120 -78.05 -18.9 55.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.13 176.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.603 ' ND2' ' HA ' ' A' ' 8' ' ' LEU . 96.9 m-20 -66.51 -52.18 48.73 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -57.21 -84.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.941 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.54 34.79 35.7 Favored Glycine 0 C--N 1.344 0.989 0 C-N-CA 121.356 -0.45 . . . . 0.0 114.111 178.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.97 -56.27 23.75 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 117.272 0.536 . . . . 0.0 111.163 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -144.64 107.31 4.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.886 0.374 . . . . 0.0 110.879 -177.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.7 mtm -70.18 -32.5 70.47 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.747 0.308 . . . . 0.0 110.818 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.7 -22.8 67.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.915 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.638 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 3.2 pt20 -83.94 -27.02 28.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.077 -176.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.8 t -75.47 -35.64 60.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 173.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.32 -48.28 80.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.043 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.75 -44.13 43.21 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.276 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -63.3 -41.82 99.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.452 0.168 . . . . 0.0 111.262 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' HD22 ' A' ' 25' ' ' LEU . 3.4 mm? -79.21 -22.82 44.34 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.8 m 60.83 50.02 5.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.301 -175.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.6 mm? -61.29 131.08 92.14 Favored Pre-proline 0 N--CA 1.461 0.122 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 5.8 Cg_exo -73.69 154.24 49.17 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.144 1.896 . . . . 0.0 110.441 168.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.587 ' HA ' HG22 ' A' ' 30' ' ' VAL . 0.9 OUTLIER -65.98 -26.98 67.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.018 0.437 . . . . 0.0 110.801 -176.077 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -63.37 -40.67 97.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.279 0.561 . . . . 0.0 110.073 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.519 HG11 ' HB2' ' A' ' 47' ' ' LEU . 24.4 t -77.22 -43.8 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.342 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.7 m -56.02 -37.24 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 121.157 0.503 . . . . 0.0 109.997 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.19 -51.91 58.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.672 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.63 -37.1 86.41 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.163 0.506 . . . . 0.0 110.524 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -43.48 95.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.02 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.0 9.68 2.81 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -65.93 131.56 46.55 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.048 0.84 . . . . 0.0 110.666 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -91.1 -7.72 50.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.994 0.425 . . . . 0.0 110.903 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 6.9 m-90 -91.15 102.38 15.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.687 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -90.52 65.46 6.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -62.77 12.58 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.2 t0 54.54 71.52 0.52 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.559 1.072 . . . . 0.0 109.75 -169.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -115.34 157.12 24.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.245 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 67.1 t -86.2 116.15 28.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 48' ' ' ALA . 55.3 tpp -71.26 103.71 2.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.566 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -99.94 -9.13 23.13 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -90.39 127.78 36.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 109.718 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.606 ' HD3' ' N ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -78.48 -19.59 52.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.288 -170.15 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -75.76 -19.37 59.07 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.228 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HB3' ' SD ' ' A' ' 43' ' ' MET . . . -85.29 -59.07 2.43 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.42 -47.68 2.86 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-N 115.176 -0.92 . . . . 0.0 114.083 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 m -65.4 -45.49 83.78 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 118.207 1.003 . . . . 0.0 111.619 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.14 -3.06 24.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.0 mm -59.73 -35.78 61.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -145.2 82.65 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 173.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 21.4 p -108.79 -45.53 3.8 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.889 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.488 HD11 ' H ' ' A' ' 15' ' ' ALA . 6.7 tt -63.99 -44.43 92.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.932 -174.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.63 55.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.037 0.446 . . . . 0.0 110.371 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.47 HG23 HG11 ' A' ' 61' ' ' VAL . 43.6 m -80.9 -32.0 34.96 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.581 175.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 19.2 mmmt -82.04 -16.75 49.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.846 177.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.2 mt -66.71 -67.17 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 171.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -178.1 127.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.47 HG11 HG23 ' A' ' 57' ' ' THR . 9.3 p -172.56 32.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 122.109 0.957 . . . . 0.0 109.778 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.0 m -102.79 120.95 53.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 O-C-N 121.769 -0.582 . . . . 0.0 111.605 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.3 -56.78 5.06 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.427 174.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 17.8 Cg_endo -100.74 -140.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.355 2.703 . . . . 0.0 113.271 -170.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.514 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 24.1 m-20 -75.3 5.49 5.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.58 -175.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 139.75 -75.46 0.36 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -177.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.67 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.0 p30 -69.07 156.77 38.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.827 -0.686 . . . . 0.0 110.901 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 68' ' ' LEU . 4.0 mm? 70.05 29.21 3.91 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.266 0.626 . . . . 0.0 112.533 174.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.594 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.6 p-80 -78.08 67.57 3.95 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.254 0.549 . . . . 0.0 111.284 174.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.452 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 44.7 p-80 -86.61 -45.74 10.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.837 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.96 -55.36 30.77 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.317 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -59.94 -28.39 67.58 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.705 -0.248 . . . . 0.0 111.488 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.62 -34.98 74.83 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.345 0.593 . . . . 0.0 110.983 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 70.5 mmtt -78.56 -37.32 43.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 109.241 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.77 -40.01 94.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.637 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -62.59 -34.06 76.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.073 177.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.08 -32.08 69.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.994 177.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 89.1 mtp -70.67 -35.14 72.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.778 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -90.28 -14.83 32.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.478 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.456 ' O ' HD13 ' A' ' 8' ' ' LEU . 70.3 m-70 -140.05 92.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.361 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.29 -73.59 0.46 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.876 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.896 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.39 145.26 30.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.959 0.409 . . . . 0.0 111.248 -175.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -87.78 177.13 7.09 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.027 175.205 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -40.45 65.56 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.38 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.727 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 13.0 t -72.12 -33.55 67.9 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.119 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.483 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 68.6 mtp -81.4 -39.15 25.43 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 121.96 -0.463 . . . . 0.0 109.886 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -60.22 -37.92 81.78 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 173.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.438 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.36 -24.93 60.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.685 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.727 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.2 mm-40 -79.87 -25.92 40.5 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.404 -0.518 . . . . 0.0 109.898 173.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 22.7 tp -87.62 -44.2 11.4 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.954 -174.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 87' ' ' ALA . 14.5 m -57.24 -36.03 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.179 -176.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.41 -44.18 95.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.952 0.406 . . . . 0.0 110.181 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.449 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -68.32 -42.38 84.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.234 175.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 57.8 mt -54.87 -49.2 72.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.307 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -70.77 -35.12 72.45 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.487 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.4 -56.39 2.84 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.26 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 21.7 m -72.73 -29.73 63.59 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.17 -34.17 76.97 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.631 0.651 . . . . 0.0 110.108 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -70.39 -42.96 71.02 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.832 0.349 . . . . 0.0 111.137 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -94.08 10.37 33.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.763 0.316 . . . . 0.0 111.688 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB1' ' HD2' ' A' ' 102' ' ' PRO . . . -64.53 156.3 77.93 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.445 ' HD2' ' HB1' ' A' ' 101' ' ' ALA . 9.8 Cg_endo -50.87 156.4 4.74 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.251 2.634 . . . . 0.0 112.464 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.7 Cg_exo -68.68 24.48 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.555 2.837 . . . . 0.0 113.496 -175.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 102' ' ' PRO . 17.0 m120 -110.79 105.12 13.86 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.54 84.95 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.159 0.504 . . . . 0.0 109.944 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.8 t70 -101.17 103.94 15.0 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.563 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -37.58 -50.39 1.14 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 114.317 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.556 ' O ' HG22 ' A' ' 111' ' ' THR . 5.4 t -95.26 -20.93 18.78 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.037 0.835 . . . . 0.0 113.189 -176.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.736 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 56.2 mmm -74.55 -29.07 61.22 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.026 0.83 . . . . 0.0 112.334 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 111' ' ' THR . 27.5 pttt -56.34 -45.45 80.39 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.492 -172.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 108' ' ' CYS . 14.6 t -57.61 -16.36 10.13 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.711 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.538 ' O ' ' HG3' ' A' ' 116' ' ' MET . 3.1 mp -90.07 -37.2 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.43 -37.98 79.5 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.865 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.95 -37.45 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.55 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.01 -52.67 64.01 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.538 ' HG3' ' O ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -69.72 -19.73 63.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.396 178.681 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.588 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 5.0 t -71.58 -30.62 66.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.493 173.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.417 ' HA ' HG12 ' A' ' 93' ' ' ILE . 86.7 t80 -76.78 -45.95 26.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.794 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' HG22 ' A' ' 122' ' ' ILE . 3.3 pttp -70.32 -30.0 66.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.357 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.588 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -66.69 -44.44 81.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.179 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 23.9 mm-40 -59.01 -53.54 57.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.172 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.524 ' HA ' HD12 ' A' ' 125' ' ' LEU . 8.5 tt -55.74 -32.93 32.74 Favored 'Isoleucine or valine' 0 C--N 1.345 0.4 0 CA-C-N 118.023 0.374 . . . . 0.0 111.401 -178.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -71.3 -33.37 69.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.2 ttpt -76.59 -15.58 59.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.238 0.542 . . . . 0.0 110.7 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 87.0 mt -81.18 10.49 5.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.601 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -135.0 -126.62 0.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 O-C-N 122.236 -0.29 . . . . 0.0 110.281 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -67.11 99.71 0.7 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.967 0.413 . . . . 0.0 111.598 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 12.9 p -164.35 132.67 2.67 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.203 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 3.9 Cg_exo -78.15 54.99 5.16 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.091 2.527 . . . . 0.0 111.599 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -79.42 106.41 11.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.019 0.438 . . . . 0.0 110.644 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.7 ptt? -147.55 123.0 10.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.932 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -117.72 162.76 17.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.22 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.4 tp -77.47 99.45 5.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.89 0.376 . . . . 0.0 110.043 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 11.0 m -66.23 111.67 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.859 178.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -88.12 133.73 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-O 121.083 0.468 . . . . 0.0 110.251 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -132.5 136.18 8.58 Favored Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.39 110.85 12.49 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.666 0.27 . . . . 0.0 110.857 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 32.3 t -89.09 76.96 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.536 ' H ' ' CD1' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -78.3 138.61 38.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.759 -174.556 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.42 101.07 6.97 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.576 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -77.09 146.44 37.24 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.1 m . . . . . 0 C--O 1.248 1.015 0 CA-C-O 119.071 -0.49 . . . . 0.0 111.399 -177.869 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.706 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 8.0 m . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 111.463 0.172 . . . . 0.0 111.463 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.706 ' HD3' ' HB2' ' A' ' 1' ' ' SER . 36.2 Cg_exo -62.83 -18.05 62.61 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.517 2.145 . . . . 0.0 113.578 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -45.02 -69.52 0.13 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.544 0.527 . . . . 0.0 112.133 -176.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.606 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -87.2 -9.09 11.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.415 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 75.4 mtp -74.93 -25.6 59.01 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -177.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 2' ' ' PRO . 21.3 pttp -97.03 89.26 4.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.449 0.642 . . . . 0.0 109.721 173.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.02 125.18 24.09 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.003 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -59.32 -33.85 71.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.781 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -61.86 -38.07 86.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.164 0.507 . . . . 0.0 110.082 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -75.39 -30.91 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.302 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.24 -55.99 10.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.296 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -47.78 -74.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.034 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.621 ' HA2' ' HG3' ' A' ' 16' ' ' MET . . . 54.65 33.48 55.03 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.219 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -68.38 -43.05 78.21 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.506 0.653 . . . . 0.0 110.189 178.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.12 66.78 1.31 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.172 0.51 . . . . 0.0 110.905 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.621 ' HG3' ' HA2' ' A' ' 13' ' ' GLY . 73.4 mtm -70.35 -25.01 63.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.78 -31.86 62.98 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.663 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 23.9 mt-30 -87.97 -25.37 23.2 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.059 -0.656 . . . . 0.0 111.091 -172.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -71.46 -35.33 70.84 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.937 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.31 -52.62 62.93 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.114 -178.063 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.03 -36.95 67.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.53 -175.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 15.6 tt0 -68.63 -42.27 78.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.727 0.299 . . . . 0.0 111.201 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.749 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 18.0 mt -84.2 -1.08 54.52 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.822 0.344 . . . . 0.0 110.664 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 63.69 36.59 10.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.304 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.937 ' HB2' ' HD3' ' A' ' 20' ' ' LYS . 1.2 mm? -49.41 119.16 8.87 Favored Pre-proline 0 N--CA 1.471 0.59 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.73 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.564 ' HD2' ' CD2' ' A' ' 47' ' ' LEU . 12.7 Cg_exo -73.93 154.17 47.87 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.416 2.077 . . . . 0.0 109.861 167.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -55.79 -32.9 63.91 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.443 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -66.03 -53.02 43.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.855 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.579 ' CB ' HD23 ' A' ' 47' ' ' LEU . 36.0 t -70.35 -50.68 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.718 -176.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.518 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 8.8 p -59.7 -33.4 51.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.152 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.93 -51.17 58.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.556 177.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.92 -32.58 73.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.064 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.6 tp -48.44 -55.38 11.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.081 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.92 13.39 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.466 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 52.0 t30 -53.86 122.31 9.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 119.521 1.055 . . . . 0.0 111.803 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -71.79 -33.15 68.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.917 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 31.0 m-90 -79.04 145.41 33.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.14 0.495 . . . . 0.0 110.965 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.57 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.65 54.28 2.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.462 -173.516 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.508 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 27.7 t70 -43.52 -42.59 5.03 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.9 t70 63.08 70.44 0.54 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 118.861 0.755 . . . . 0.0 109.853 -175.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.508 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 1.5 p90 -106.3 175.5 5.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.8 -175.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 93.6 t -84.1 125.14 40.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.754 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttp -77.71 96.03 4.77 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.214 0.531 . . . . 0.0 110.226 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -103.42 -39.11 6.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.755 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.408 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 10.2 t70 -69.42 124.85 24.96 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.74 0.781 . . . . 0.0 110.07 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.561 ' HG2' ' HG2' ' A' ' 109' ' ' MET . 2.5 mpt_? -79.89 -28.06 39.92 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.717 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.737 HD11 HD22 ' A' ' 25' ' ' LEU . 7.4 tp -69.61 -19.06 63.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.948 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.57 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -78.37 -60.61 2.3 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.91 -46.78 1.78 Allowed Glycine 0 CA--C 1.534 1.227 0 CA-C-N 114.399 -1.273 . . . . 0.0 114.654 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 74.2 m -66.85 -43.61 83.2 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.522 1.161 . . . . 0.0 110.619 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.5 -22.07 66.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.761 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 48' ' ' ALA . 47.8 mm -61.83 -36.23 72.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-O 120.903 0.382 . . . . 0.0 111.127 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -122.2 76.88 1.34 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.557 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.7 p -125.19 -47.29 1.76 Allowed 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.301 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.9 tt -63.53 -65.51 0.67 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 111.786 -168.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.15 -12.47 59.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.252 0.548 . . . . 0.0 110.016 -174.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.538 ' HA ' HG11 ' A' ' 61' ' ' VAL . 56.3 m -83.9 -33.05 24.83 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.726 176.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 8.1 mmmt -75.35 -23.44 57.2 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.363 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.5 mt -63.79 -66.28 0.56 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.571 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -177.4 123.96 0.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.588 HG23 ' CD2' ' A' ' 76' ' ' PHE . 10.4 p -178.67 34.57 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.99 0.9 . . . . 0.0 110.139 -174.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.716 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 28.1 m -98.82 114.02 35.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.802 0.811 . . . . 0.0 112.227 -170.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.23 -56.31 10.99 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.954 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.565 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 13.6 Cg_endo -97.91 -138.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 123.311 2.674 . . . . 0.0 113.254 -170.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.2 m-20 -72.24 2.39 6.06 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.622 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.19 -75.92 0.3 Allowed Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.8 p-10 -75.17 170.91 15.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.803 -0.699 . . . . 0.0 110.317 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 69.66 29.79 4.11 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.519 0.512 . . . . 0.0 111.621 173.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.716 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 3.5 p80 -73.11 79.89 1.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.392 0.615 . . . . 0.0 110.984 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 21.9 p-80 -85.1 -58.85 2.52 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.651 -177.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.0 -61.49 6.37 Favored Glycine 0 N--CA 1.443 -0.867 0 C-N-CA 121.154 -0.545 . . . . 0.0 113.171 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -54.1 -36.02 62.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -71.55 -37.89 71.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.204 0.525 . . . . 0.0 111.337 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.461 ' NZ ' HG21 ' A' ' 94' ' ' ILE . 92.2 mttt -81.37 -30.45 33.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.002 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.13 -41.64 94.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.144 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.588 ' CD2' HG23 ' A' ' 61' ' ' VAL . 2.5 m-85 -62.57 -36.65 83.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.857 176.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.9 -40.27 75.73 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.639 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.629 ' HB3' ' CB ' ' A' ' 87' ' ' ALA . 1.7 ptt? -76.92 -14.87 59.82 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.645 ' HG3' ' HD2' ' A' ' 80' ' ' HIS . 18.5 ptpt -90.88 -18.61 24.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.126 173.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.645 ' HD2' ' HG3' ' A' ' 79' ' ' LYS . 12.3 p80 -149.77 99.49 2.86 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.683 0.278 . . . . 0.0 111.565 172.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.18 -75.97 0.41 Allowed Glycine 0 C--O 1.234 0.123 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.099 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.606 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -89.22 149.94 22.88 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.297 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.651 ' OD2' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -88.7 167.4 13.36 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -72.56 -23.31 60.96 Favored 'General case' 0 N--CA 1.421 -1.907 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.716 -166.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.651 ' HB ' ' OD2' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -73.29 -34.35 65.71 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.338 176.672 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.474 ' HA ' HE21 ' A' ' 89' ' ' GLN . 3.3 tpt -77.27 -43.52 33.02 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.111 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.629 ' CB ' ' HB3' ' A' ' 78' ' ' MET . . . -65.24 -41.59 94.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.353 175.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -69.23 -26.25 64.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -175.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.474 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.7 pt20 -82.78 -28.9 29.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.844 175.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -76.93 -46.73 23.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 87' ' ' ALA . 25.4 m -57.69 -35.9 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.892 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.21 -44.51 88.06 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.924 0.392 . . . . 0.0 110.567 -176.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.582 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.2 mp -60.21 -42.66 91.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.455 174.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.506 ' HA ' ' HB ' ' A' ' 114' ' ' VAL . 59.6 mt -55.25 -47.17 78.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.312 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -67.07 -31.45 71.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.429 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 99' ' ' LYS . . . -80.97 -50.67 5.08 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.374 -173.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 13.8 m -73.61 -32.75 64.24 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.171 -0.612 . . . . 0.0 112.21 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 94' ' ' ILE . 8.7 tp10 -57.89 -38.48 75.87 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.434 0.561 . . . . 0.0 110.416 168.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 96' ' ' GLY . 31.8 ttpt -63.48 -40.85 98.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.592 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.8 m -102.11 24.41 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.305 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.69 152.92 49.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 55.7 Cg_endo -69.87 162.19 43.08 Favored 'Trans proline' 0 CA--C 1.529 0.249 0 C-N-CA 122.578 2.186 . . . . 0.0 112.275 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 17.0 Cg_exo -69.2 59.01 1.33 Allowed 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.402 2.735 . . . . 0.0 112.587 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -103.93 113.28 26.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.504 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -79.0 16.31 0.94 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.811 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.1 t70 -90.85 112.18 23.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.093 0.473 . . . . 0.0 110.581 -176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.63 ' HA ' ' HE3' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.47 -54.25 3.17 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.557 ' O ' HD13 ' A' ' 112' ' ' ILE . 68.4 m -83.33 -21.91 33.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.371 0.987 . . . . 0.0 112.187 -176.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.811 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 5.7 mmm -63.33 -44.54 94.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.161 0.505 . . . . 0.0 110.57 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.634 ' HA ' ' OD2' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -66.17 -49.26 67.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.058 -177.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.448 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.64 -13.83 4.53 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.98 175.183 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.2 mp -91.06 -41.56 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 O-C-N 121.933 -0.479 . . . . 0.0 110.03 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.634 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 3.2 p30 -63.08 -34.15 76.97 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.494 177.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 18.8 m -80.09 -36.31 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.49 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.53 -50.5 72.42 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 121.701 0.763 . . . . 0.0 111.339 176.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.756 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.3 ptt? -68.72 -17.75 64.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.784 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 25.8 t -71.92 -30.55 65.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.601 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.582 ' HB2' HG21 ' A' ' 93' ' ' ILE . 85.4 t80 -72.04 -44.91 62.6 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.776 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.429 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.68 -29.25 66.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 118.139 -1.424 . . . . 0.0 111.276 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.756 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.61 -56.21 19.15 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.756 170.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.53 -51.04 71.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.409 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -32.79 41.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 118.22 0.464 . . . . 0.0 111.287 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -71.98 -31.9 66.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.455 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -79.05 -36.19 41.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.779 ' HA ' ' HB ' ' A' ' 128' ' ' VAL . 0.5 OUTLIER -72.15 -15.31 61.97 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.116 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -56.88 -54.63 44.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.748 0.309 . . . . 0.0 111.398 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 26.0 p-90 -112.22 27.12 9.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.779 ' HB ' ' HA ' ' A' ' 125' ' ' LEU . 7.0 p -40.01 109.12 0.56 Allowed Pre-proline 0 N--CA 1.468 0.472 0 O-C-N 124.125 0.891 . . . . 0.0 113.007 -171.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -94.12 -19.63 0.41 Allowed 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.293 2.662 . . . . 0.0 113.318 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -90.33 94.61 9.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.119 0.485 . . . . 0.0 110.51 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.09 21.45 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -111.4 119.89 40.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.652 -173.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 53.5 tp -160.09 111.4 1.95 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.325 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.5 p -86.99 102.44 12.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 110.654 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.589 ' H ' HD13 ' A' ' 135' ' ' ILE . 0.2 OUTLIER -98.42 118.95 45.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.935 178.049 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 174.35 143.27 4.33 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.963 -1.113 . . . . 0.0 112.41 176.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.585 ' HG2' ' H ' ' A' ' 138' ' ' VAL . 25.3 tt0 -128.24 176.88 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.585 ' H ' ' HG2' ' A' ' 137' ' ' GLU . 34.4 m -85.05 116.5 28.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.19 0.519 . . . . 0.0 111.458 -176.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 7.2 mp -74.23 92.86 2.27 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -88.45 169.69 11.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.769 -169.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.85 152.79 20.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.684 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.874 0 CA-C-O 119.584 -0.246 . . . . 0.0 110.396 -179.919 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.475 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 65.4 p . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.624 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 2.6 Cg_exo -77.27 5.73 4.86 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.546 2.83 . . . . 0.0 114.921 -170.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -49.06 -70.57 0.09 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.607 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.9 tp -86.31 -9.47 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 121.124 0.488 . . . . 0.0 111.467 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.624 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 85.3 mtp -77.71 -30.6 51.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.959 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -84.7 94.37 8.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.219 0.533 . . . . 0.0 109.838 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -71.94 115.6 11.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.182 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 8' ' ' LEU . 5.8 mp -58.48 -37.73 76.14 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.342 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.548 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 6.1 p -65.08 -28.74 69.67 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.96 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.98 -26.51 56.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.894 175.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 8' ' ' LEU . 0.8 OUTLIER -66.82 -45.66 77.59 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.107 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.548 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 67.9 m-85 -55.23 -84.37 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.381 171.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.02 36.79 15.33 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.688 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -66.34 -37.62 85.75 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.812 0.339 . . . . 0.0 111.012 -177.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.14 92.23 2.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.071 0.462 . . . . 0.0 109.85 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttp -71.32 -33.08 69.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.0 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.0 -29.3 65.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.064 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -88.52 -21.23 24.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.876 -172.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.9 t -74.85 -36.17 62.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -63.49 -45.56 90.17 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.384 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.84 -47.63 58.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.87 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.9 tp10 -67.96 -40.69 83.15 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.45 ' HB2' HD22 ' A' ' 25' ' ' LEU . 2.2 mm? -77.81 -21.52 51.43 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.468 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 61.67 48.16 5.83 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.843 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.875 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -61.29 128.34 89.52 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.359 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.4 Cg_exo -66.46 149.85 84.42 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.812 1.675 . . . . 0.0 109.694 170.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -61.06 -31.65 71.3 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 121.152 -0.219 . . . . 0.0 110.975 -175.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.4 m -66.46 -46.39 76.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.875 0.369 . . . . 0.0 110.801 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 47' ' ' LEU . 38.3 t -71.38 -52.73 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.626 -176.212 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 5.0 p -60.2 -34.97 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.871 -175.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.36 -51.52 59.88 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.94 0.4 . . . . 0.0 111.267 177.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.68 -37.46 76.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.578 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.542 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 1.6 pp -59.81 -30.64 69.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.536 177.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -62.86 9.8 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 174.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -56.03 110.18 0.7 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 120.474 1.488 . . . . 0.0 111.367 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -76.48 -14.96 60.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.059 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -88.2 157.95 18.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -87.07 53.6 2.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.779 0.8 . . . . 0.0 109.959 175.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.579 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 10.6 t70 -42.78 -45.5 4.84 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.818 177.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 63.04 70.47 0.55 Allowed 'General case' 0 C--N 1.347 0.481 0 CA-C-O 121.639 0.733 . . . . 0.0 109.85 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 14.9 p90 -109.76 164.05 12.93 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.305 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 38.2 t -84.17 113.91 23.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.417 ' HB3' HG21 ' A' ' 112' ' ' ILE . 38.6 ttm -70.99 104.32 2.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.17 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -108.22 -18.43 13.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.392 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.15 139.68 30.39 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.94 0.876 . . . . 0.0 111.382 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.556 ' HA ' ' HG2' ' A' ' 109' ' ' MET . 6.7 mpt_? -70.72 -32.65 69.91 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.898 -1.501 . . . . 0.0 110.608 -171.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.643 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.3 mm? -73.62 -15.07 61.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.968 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.64 -61.03 2.09 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.618 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.11 -48.01 3.48 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.079 -0.964 . . . . 0.0 114.586 168.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 m -66.15 -42.66 88.72 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.495 1.148 . . . . 0.0 111.56 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.94 -23.14 67.25 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.2 mm -55.79 -38.35 51.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.053 0.454 . . . . 0.0 110.329 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -131.27 81.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.214 1.007 . . . . 0.0 110.142 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.5 t -114.58 -47.19 2.92 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.706 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.468 ' O ' HD23 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.33 -68.02 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.016 0.436 . . . . 0.0 111.195 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.55 -10.46 59.45 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.087 0.47 . . . . 0.0 110.612 -172.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.956 HG23 HG11 ' A' ' 61' ' ' VAL . 51.7 m -78.8 -35.8 43.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 174.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . 3.1 mtpt -80.64 -17.31 51.65 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.514 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.468 HD23 ' O ' ' A' ' 55' ' ' LEU . 3.8 mm? -63.93 -60.16 3.61 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.127 170.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -176.02 116.86 0.13 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.603 0.24 . . . . 0.0 110.848 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.956 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -155.0 31.37 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.515 0.674 . . . . 0.0 110.501 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.668 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.4 m -107.84 121.65 61.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 O-C-N 121.761 -0.587 . . . . 0.0 111.901 -174.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -76.2 -57.49 1.39 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.218 174.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.76 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 65.9 Cg_endo -104.18 -138.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.768 2.979 . . . . 0.0 113.596 -167.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.8 m-20 -72.2 12.01 0.5 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.895 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.56 -74.59 0.39 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 7.5 p30 -70.28 153.12 43.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.249 -0.475 . . . . 0.0 110.386 176.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.58 36.69 2.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.384 0.611 . . . . 0.0 110.645 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.76 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 8.5 p80 -72.37 79.88 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.535 0.683 . . . . 0.0 111.045 175.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -86.94 -60.38 2.0 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.085 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.78 -62.26 6.3 Favored Glycine 0 CA--C 1.507 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 113.115 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -59.14 -23.54 62.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.09 64.95 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.272 0.558 . . . . 0.0 110.769 178.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.747 ' HE2' HG12 ' A' ' 91' ' ' VAL . 32.0 mmmt -80.3 -32.5 38.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.823 177.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.48 -39.9 94.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.685 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -63.49 -42.81 98.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.628 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.04 -37.78 72.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.611 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.1 mtm -69.92 -32.13 70.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.601 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HD2' ' HA ' ' A' ' 79' ' ' LYS . 16.9 tptm -93.25 -10.32 36.01 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.822 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.512 ' HB3' HD22 ' A' ' 8' ' ' LEU . 75.7 m-70 -141.96 89.74 2.21 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 122.076 -0.39 . . . . 0.0 110.85 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' A' ' 8' ' ' LEU . . . 127.35 -68.17 0.54 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.793 174.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.607 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -106.34 140.85 38.62 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.851 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.37 159.65 29.35 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -61.6 -49.83 75.03 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.744 -164.765 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 7.0 t -60.14 -28.7 68.11 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.959 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.7 tpt -79.86 -46.24 17.21 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.48 0.657 . . . . 0.0 109.735 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.65 -35.78 70.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.805 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.12 -25.17 60.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.594 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.0 mm-40 -75.65 -23.54 56.3 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 172.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.65 ' O ' HG13 ' A' ' 94' ' ' ILE . 36.3 tp -84.98 -41.98 15.35 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.255 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.747 HG12 ' HE2' ' A' ' 74' ' ' LYS . 35.1 m -57.6 -35.81 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -66.22 -44.12 84.73 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.232 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.821 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.4 mp -62.11 -44.18 98.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.606 173.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.65 HG13 ' O ' ' A' ' 90' ' ' LEU . 39.2 mt -51.89 -47.06 41.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-O 120.716 0.293 . . . . 0.0 110.526 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.53 -36.6 73.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.923 0.392 . . . . 0.0 110.641 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.59 -42.32 7.87 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 119.979 -1.105 . . . . 0.0 112.004 -173.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.629 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.2 m -73.23 -41.44 63.73 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HG2' HG11 ' A' ' 114' ' ' VAL . 24.1 mm-40 -56.68 -38.73 72.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.45 171.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -69.68 -42.73 73.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.755 0.312 . . . . 0.0 111.661 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.0 m -96.86 8.01 45.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.37 149.83 94.11 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.04 164.85 4.48 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.111 2.541 . . . . 0.0 112.265 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 38.63 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.437 2.758 . . . . 0.0 113.212 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.45 104.98 16.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.718 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.83 87.05 4.71 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.4 t0 -112.05 104.23 12.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.279 -174.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -35.69 -76.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 124.595 1.184 . . . . 0.0 113.787 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.1 t -94.99 -15.59 23.41 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.556 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 1.9 mmm -86.02 -22.99 26.98 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -168.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.716 ' HD3' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.57 -38.6 81.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 122.069 0.938 . . . . 0.0 110.076 -175.367 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.919 HG22 HD12 ' A' ' 112' ' ' ILE . 0.6 OUTLIER -56.27 -16.86 6.1 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.101 -1.409 . . . . 0.0 112.291 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.919 HD12 HG22 ' A' ' 111' ' ' THR . 1.8 mp -91.17 -36.74 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -58.72 -37.1 75.42 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.199 176.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.616 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 4.8 m -80.71 -32.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.656 0.741 . . . . 0.0 109.971 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.57 -48.93 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.746 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.0 ptt? -69.18 -13.65 62.53 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.366 177.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.93 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 52.5 t -73.64 -31.75 63.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.758 173.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.821 ' HB2' HG21 ' A' ' 93' ' ' ILE . 74.2 t80 -74.17 -47.1 38.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.173 177.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.467 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.45 -23.99 63.74 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 118.492 -1.283 . . . . 0.0 110.163 -178.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.93 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 25.0 ttpt -56.73 -54.09 50.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.017 0.437 . . . . 0.0 110.314 166.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -58.73 -48.81 79.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.539 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.467 HG22 ' HA ' ' A' ' 119' ' ' LYS . 10.7 tt -58.44 -30.13 40.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 CA-C-N 118.361 0.528 . . . . 0.0 110.762 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 1.2 m80 -71.28 -32.52 68.77 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.82 -33.72 74.3 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.433 0.635 . . . . 0.0 109.783 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.9 -36.97 84.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.516 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 64.64 -79.25 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.828 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' TRP . . . . . 0.445 ' H ' ' HD1' ' A' ' 127' ' ' TRP . 3.0 p-90 -93.71 -171.83 2.71 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.595 -176.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.6 p -99.4 126.06 38.96 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.766 0.317 . . . . 0.0 111.006 -178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.92 161.38 18.94 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.887 2.391 . . . . 0.0 112.582 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.57 133.76 34.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.932 -176.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.95 160.4 14.41 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.045 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -94.26 159.42 15.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 54.8 tp -119.51 123.19 43.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.949 0.404 . . . . 0.0 111.632 -174.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 2.8 m -78.15 119.61 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.071 172.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 135' ' ' ILE . 11.3 mm -88.35 116.79 30.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 110.162 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -98.49 112.81 4.56 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.924 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -83.37 99.14 9.86 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 41.8 t -100.54 108.65 23.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.988 -176.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.7 tp -148.69 93.6 2.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.987 174.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -104.7 16.32 26.24 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.504 0.668 . . . . 0.0 109.967 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.505 ' HG3' HG23 ' A' ' 142' ' ' VAL . 7.8 tp10 -104.57 135.87 45.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.868 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.505 HG23 ' HG3' ' A' ' 141' ' ' GLU . 41.5 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.412 -178.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.462 ' HA ' ' OD1' ' A' ' 132' ' ' ASP . 32.2 p . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.577 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 36.9 Cg_exo -60.54 -21.42 68.48 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.987 2.458 . . . . 0.0 112.761 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -50.79 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.851 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.2 tt -83.16 -9.85 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.345 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.577 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.1 ttt -66.32 -28.66 68.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.244 0.545 . . . . 0.0 109.887 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -83.6 100.24 10.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.754 172.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -61.8 137.8 58.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.524 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.2 mt -54.18 -34.53 60.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.201 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.6 p -62.16 -40.75 97.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.277 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -77.12 -30.45 55.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -68.21 -55.34 12.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -57.56 -82.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 170.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.19 36.35 35.93 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.804 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -69.37 -49.62 53.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.198 0.499 . . . . 0.0 110.383 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -153.8 105.39 2.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.488 178.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 54.7 ttp -75.47 -21.78 57.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.254 0.55 . . . . 0.0 110.194 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -63.03 -23.91 67.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.716 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.683 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 21.0 pt20 -84.56 -25.69 28.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.335 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.0 m -75.25 -35.45 61.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.513 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.09 -49.5 74.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.209 -178.096 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -70.62 -43.09 69.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.424 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.683 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.5 tm-20 -62.0 -44.29 97.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.966 -175.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.448 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 15.2 mt -81.98 -13.65 57.14 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.637 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.0 m 57.64 38.36 27.69 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.091 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.605 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 19.2 mt -51.01 120.94 14.66 Favored Pre-proline 0 N--CA 1.465 0.325 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.093 -174.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.3 Cg_exo -69.05 154.46 70.53 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.165 1.91 . . . . 0.0 111.036 174.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.637 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.3 p-10 -65.63 -27.34 68.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.678 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -64.64 -40.52 95.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 109.566 174.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.3 t -72.85 -50.1 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.234 -177.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.8 m -54.98 -30.75 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 120.876 0.369 . . . . 0.0 110.21 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.21 -51.53 63.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.554 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -70.62 -39.22 73.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.453 0.644 . . . . 0.0 109.748 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 2.7 tm? -51.25 -54.35 26.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.576 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.24 9.66 0.07 Allowed 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -66.67 104.27 1.26 Allowed 'General case' 0 C--N 1.345 0.404 0 CA-C-N 120.332 1.423 . . . . 0.0 109.483 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -86.49 -20.16 28.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.512 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -90.27 142.32 27.84 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.439 0.638 . . . . 0.0 110.894 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.665 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -80.64 65.73 5.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.092 -171.858 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -62.39 -27.4 69.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.656 170.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.5 t70 63.09 70.66 0.54 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.593 0.711 . . . . 0.0 109.563 -172.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.4 p90 -95.63 163.15 13.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.082 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.8 t -87.97 121.64 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.552 ' O ' HG21 ' A' ' 112' ' ' ILE . 43.4 tpp -76.45 104.68 7.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.474 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 p -110.13 -4.79 15.59 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.76 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -96.4 131.45 42.94 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 110.443 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.477 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 8.8 mpt_? -73.02 -23.9 60.67 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.87 -171.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.605 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.8 mm? -78.16 -18.12 55.95 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.055 0.455 . . . . 0.0 109.928 -177.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -85.16 -55.81 3.86 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -175.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.44 -48.32 2.94 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.939 165.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.7 m -64.12 -42.02 97.01 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.143 0.971 . . . . 0.0 111.667 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.539 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.1 mm -63.77 -29.74 48.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.963 0.411 . . . . 0.0 111.34 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -135.8 44.49 2.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.933 0.397 . . . . 0.0 111.362 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.552 ' SG ' HD12 ' A' ' 55' ' ' LEU . 24.6 p -94.27 -36.15 12.12 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.552 HD12 ' SG ' ' A' ' 54' ' ' CYS . 8.6 mp -56.41 -69.67 0.14 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -170.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.477 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.75 -8.8 59.73 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.061 0.458 . . . . 0.0 110.777 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.609 ' HA ' HG11 ' A' ' 61' ' ' VAL . 55.8 m -80.47 -35.16 35.23 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.297 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HE2' ' HG3' ' A' ' 22' ' ' GLU . 16.9 mmmt -77.64 -21.84 51.63 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.4 173.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.9 mt -65.05 -65.84 0.62 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.814 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.16 119.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.609 HG11 ' HA ' ' A' ' 57' ' ' THR . 10.6 p -178.4 34.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.613 0.72 . . . . 0.0 111.13 -177.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.68 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.7 m -102.24 118.78 49.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.953 -1.092 . . . . 0.0 111.256 -173.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.16 -56.01 14.33 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.265 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.611 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 8.7 Cg_endo -95.01 -139.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.009 2.473 . . . . 0.0 112.854 -171.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.45 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 3.8 m-20 -76.27 11.18 1.63 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.587 -176.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.8 -75.41 0.4 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.523 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.3 p30 -75.33 159.3 31.62 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.03 -0.585 . . . . 0.0 111.158 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 68.95 43.24 1.18 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.255 0.55 . . . . 0.0 111.967 174.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.68 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 6.7 p80 -83.34 76.0 9.94 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.476 0.655 . . . . 0.0 110.693 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -86.86 -61.93 1.62 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.814 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.15 -52.8 51.2 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.619 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -56.94 -34.68 68.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.286 . . . . 0.0 111.579 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.12 -36.15 74.6 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.184 0.516 . . . . 0.0 111.224 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 74' ' ' LYS . 21.1 mmmt -79.82 -35.18 38.78 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 33.3 t70 -64.18 -35.44 80.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.648 173.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.508 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 52.0 t80 -62.26 -35.27 78.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.485 176.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.21 72.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.856 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -68.2 -39.05 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.639 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 76' ' ' PHE . 34.3 pttt -93.29 -5.95 48.58 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.227 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.45 ' ND1' ' HG3' ' A' ' 79' ' ' LYS . 63.9 m80 -136.06 88.9 2.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.629 0.252 . . . . 0.0 110.75 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.22 -75.09 0.36 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.802 172.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -99.56 132.59 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.896 0.379 . . . . 0.0 111.331 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.481 ' OD2' HG22 ' A' ' 85' ' ' THR . 6.5 p-10 -79.21 172.36 13.91 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.62 -45.68 77.48 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -164.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.743 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 11.3 t -53.66 -40.69 66.1 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 58.9 mtm -82.24 -38.22 24.81 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.111 0.482 . . . . 0.0 109.701 -174.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.67 -37.58 76.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.165 172.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.76 -24.93 59.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.997 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.743 ' HG2' ' O ' ' A' ' 85' ' ' THR . 66.0 mm-40 -77.88 -23.49 48.77 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 64.1 tp -88.3 -48.26 7.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.293 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 88' ' ' GLN . 17.1 m -57.22 -38.13 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -172.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -68.14 -43.38 78.45 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.389 0.614 . . . . 0.0 110.363 -175.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.702 HG23 ' HB2' ' A' ' 117' ' ' CYS . 1.7 mp -61.8 -43.01 96.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.713 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.6 mt -55.64 -47.05 79.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.223 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -65.67 -34.71 78.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.505 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.71 -60.19 2.23 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.389 -169.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.792 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 8.8 p -74.01 -27.31 60.9 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.041 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.1 tm-20 -65.27 -38.25 89.71 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 118.576 -1.25 . . . . 0.0 109.783 171.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -64.74 -43.29 93.82 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.878 176.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -103.54 26.12 8.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.912 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.62 155.61 92.57 Favored Pre-proline 0 C--O 1.235 0.328 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' A' ' 104' ' ' ASN . 53.3 Cg_exo -53.69 164.99 1.95 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.003 2.468 . . . . 0.0 112.482 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.79 31.24 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.499 2.799 . . . . 0.0 113.169 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 102' ' ' PRO . 4.6 m-20 -122.17 94.79 4.41 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.578 176.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.38 92.88 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.2 t70 -91.01 104.59 17.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.324 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.42 ' O ' ' HD2' ' A' ' 110' ' ' LYS . 18.1 tttp -34.73 -74.35 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -167.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 27.7 t -90.82 -9.72 45.41 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.846 -0.533 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.415 ' HB2' ' OD1' ' A' ' 106' ' ' ASP . 3.0 mmm -87.74 -22.04 24.82 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -168.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.582 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -55.12 -45.85 75.57 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.703 0.763 . . . . 0.0 110.82 -173.196 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.646 HG22 HD12 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -53.97 -14.91 1.15 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.114 -1.403 . . . . 0.0 113.112 177.544 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.646 HD12 HG22 ' A' ' 111' ' ' THR . 1.7 mp -92.02 -39.06 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 -38.48 77.51 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 175.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.849 ' HA ' ' SG ' ' A' ' 117' ' ' CYS . 3.6 m -82.5 -34.07 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 CA-C-O 122.2 1.0 . . . . 0.0 110.347 -176.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.74 -43.38 90.22 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.72 173.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.588 ' HB2' ' HE2' ' A' ' 119' ' ' LYS . 22.5 ptt? -68.36 -20.01 64.68 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.301 -0.96 . . . . 0.0 112.111 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.864 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 1.4 m -66.85 -30.5 70.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 118.844 0.747 . . . . 0.0 109.228 170.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.05 -46.36 57.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.588 ' HE2' ' HB2' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.58 -21.97 62.62 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.57 177.567 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.864 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.22 -48.87 77.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 169.245 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.4 -52.12 66.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.09 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -56.95 -35.68 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 117.726 0.239 . . . . 0.0 110.906 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -72.72 -17.57 61.6 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.07 -35.02 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 122.022 -0.424 . . . . 0.0 110.576 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 82.2 mt -73.23 -39.56 65.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 54.6 -90.7 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -61.69 103.68 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.994 -170.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.426 ' HB ' ' HB2' ' A' ' 131' ' ' MET . 6.8 m -124.11 100.46 36.33 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.387 171.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.54 -85.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.929 2.419 . . . . 0.0 113.638 -172.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -110.21 28.19 8.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.234 0.54 . . . . 0.0 110.259 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.426 ' HB2' ' HB ' ' A' ' 128' ' ' VAL . 84.6 mtp -80.53 54.67 2.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.942 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.462 ' OD1' ' HA ' ' A' ' 1' ' ' SER . 19.2 t70 -148.99 105.27 3.52 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.795 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.439 ' O ' ' HD2' ' A' ' 2' ' ' PRO . 60.3 tp -79.93 86.77 5.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.214 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 7.2 p -73.2 142.0 15.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.391 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.77 126.35 66.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.005 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -102.46 135.62 12.37 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.907 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -77.82 138.09 38.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.889 0.376 . . . . 0.0 111.061 -178.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.7 t -94.8 131.85 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.745 HD23 ' H ' ' A' ' 139' ' ' LEU . 2.6 pt? -92.29 148.57 22.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.2 0.524 . . . . 0.0 111.68 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -104.53 -76.17 0.6 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 170.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 67.88 156.4 0.12 Allowed 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.958 0.787 . . . . 0.0 112.671 167.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 4.7 p . . . . . 0 C--O 1.25 1.087 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.515 179.045 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -89.13 6.1 4.68 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.769 2.312 . . . . 0.0 113.243 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -51.62 -74.17 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.726 HD11 ' HB2' ' A' ' 82' ' ' ALA . 27.3 mm -91.03 -16.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.005 0.431 . . . . 0.0 111.89 177.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.5 tpt -69.73 -34.81 74.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -100.27 105.32 16.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 9' ' ' SER . 6.1 t-20 -61.55 112.57 2.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.868 -174.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.598 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.4 pt? -64.57 -23.22 67.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.433 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.435 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m -63.65 -40.23 96.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.057 0.456 . . . . 0.0 109.84 175.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -75.95 -30.14 58.55 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.64 -51.97 43.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -56.44 -79.48 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.642 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.81 39.85 40.38 Favored Glycine 0 C--N 1.346 1.137 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.338 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -62.79 -42.45 99.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.863 0.332 . . . . 0.0 111.665 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.764 ' H ' HD21 ' A' ' 55' ' ' LEU . . . -144.55 105.01 4.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.059 0.456 . . . . 0.0 111.403 -177.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttm -75.45 -42.11 54.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.263 0.554 . . . . 0.0 110.76 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -63.36 -22.66 67.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.644 -175.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -88.0 -25.37 23.17 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.92 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' HD23 ' A' ' 23' ' ' LEU . 14.7 m -71.91 -33.85 68.63 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 170.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 25' ' ' LEU . 48.8 tptt -58.88 -55.28 37.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.911 175.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.1 -44.45 65.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.039 -174.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 19.6 tp10 -64.59 -39.27 93.43 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.728 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 4.4 mm? -82.43 -19.71 38.44 Favored 'General case' 0 CA--C 1.514 -0.435 0 O-C-N 122.213 -0.305 . . . . 0.0 110.479 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m 61.63 46.76 6.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -168.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 23' ' ' LEU . 20.5 mt -62.72 121.59 68.91 Favored Pre-proline 0 N--CA 1.453 -0.32 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.067 -170.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.615 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 24.0 Cg_exo -61.54 149.67 88.72 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.115 1.877 . . . . 0.0 110.427 176.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -59.97 -35.16 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.744 0.306 . . . . 0.0 110.973 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.3 m -69.16 -39.4 78.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.507 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 80.7 t -74.23 -52.97 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.719 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.9 p -57.53 -37.02 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.175 0.512 . . . . 0.0 110.273 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.33 61.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.221 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -71.78 -23.46 61.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.054 0.455 . . . . 0.0 110.716 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.63 -50.75 69.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.462 ' CE2' HG22 ' A' ' 30' ' ' VAL . 10.0 m-85 -77.28 10.61 2.36 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -57.54 130.49 46.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -72.46 -37.18 68.58 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -171.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 45.1 p90 -92.34 131.69 37.33 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.415 178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' H ' ' HG2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -89.38 73.31 7.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.546 0.689 . . . . 0.0 110.57 -178.129 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.491 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 36.3 t70 -42.7 -33.32 0.71 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.7 t0 67.2 51.27 0.93 Allowed 'General case' 0 C--N 1.348 0.531 0 CA-C-O 122.186 0.993 . . . . 0.0 109.715 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.491 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -91.62 178.03 6.04 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.159 174.431 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 44' ' ' THR . 25.7 t -83.33 117.93 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 29.4 ttp -67.65 92.85 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.185 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 42' ' ' VAL . 66.5 p -95.91 -8.78 33.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.527 -174.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 10.7 t70 -97.08 134.58 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.267 0.556 . . . . 0.0 111.503 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.613 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 6.2 mpt_? -76.31 -21.1 56.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.119 -174.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.615 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 3.9 mm? -79.64 -15.23 57.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.212 -176.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.41 -61.87 1.73 Allowed 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -176.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.69 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -42.45 -48.01 5.75 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.402 168.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 m -67.27 -44.46 79.26 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.581 1.191 . . . . 0.0 111.823 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.42 36.95 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.015 -0.428 . . . . 0.0 111.701 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.92 -29.37 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.424 ' O ' ' HB ' ' A' ' 57' ' ' THR . 23.3 t-20 -146.25 70.81 1.23 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.406 0.622 . . . . 0.0 110.707 175.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 58' ' ' LYS . 8.9 p -98.36 -41.77 7.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.901 174.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.764 HD21 ' H ' ' A' ' 15' ' ' ALA . 1.7 tm? -55.87 -66.0 0.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.057 0.456 . . . . 0.0 111.068 -176.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -82.75 -16.38 48.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.584 -169.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.43 HG23 ' CG2' ' A' ' 61' ' ' VAL . 23.7 m -84.16 -39.62 19.19 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.788 174.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.688 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 22.8 mmtt -81.62 -2.55 50.6 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.063 -0.398 . . . . 0.0 111.567 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 9.8 mt -64.99 -67.65 0.42 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.505 166.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -178.9 101.33 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.114 0.259 . . . . 0.0 110.978 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.43 ' CG2' HG23 ' A' ' 57' ' ' THR . 30.4 m -148.95 50.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-O 121.35 0.595 . . . . 0.0 111.169 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.644 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 5.9 m -99.9 120.58 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.85 -0.531 . . . . 0.0 110.915 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 69' ' ' HIS . 1.8 t70 -75.2 -57.73 1.66 Allowed Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.639 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 19.4 Cg_endo -98.68 -139.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.237 2.624 . . . . 0.0 113.058 -168.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 4.0 m-20 -72.63 10.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.244 -176.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.81 -70.02 0.52 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.639 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.9 p30 -75.09 154.43 37.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.86 -0.67 . . . . 0.0 111.468 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 68.99 33.78 3.34 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.695 172.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.1 p80 -79.68 69.87 6.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.914 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 2.5 p-80 -85.67 -33.24 21.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.249 177.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.41 -62.84 4.75 Favored Glycine 0 CA--C 1.511 -0.216 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.382 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' A' ' 63' ' ' ASP . 11.1 t-20 -57.52 -30.49 65.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.61 -0.295 . . . . 0.0 111.532 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.73 -36.39 65.18 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.178 0.514 . . . . 0.0 111.372 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 24.4 mmmt -80.37 -35.03 35.96 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.18 -38.8 90.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.619 ' CZ ' ' HB1' ' A' ' 56' ' ' ALA . 48.8 t80 -56.11 -43.42 78.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.923 175.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.55 -34.02 71.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.969 0.414 . . . . 0.0 111.212 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.0 mtt -74.6 -34.86 62.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.669 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.915 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 9.5 mmpt? -91.37 -10.13 42.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.551 -0.459 . . . . 0.0 111.138 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -143.5 93.87 2.53 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 128.83 -75.5 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.543 174.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.726 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -98.36 151.41 20.56 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.537 0.208 . . . . 0.0 110.743 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.585 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.4 p-10 -91.84 172.95 8.12 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -58.04 -38.08 75.6 Favored 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -170.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 8.0 t -62.44 -35.95 80.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.526 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.438 ' O ' HD13 ' A' ' 90' ' ' LEU . 59.1 mtp -83.05 -39.12 21.63 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -176.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.63 -34.41 72.76 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.59 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.791 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.36 -23.61 54.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.484 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.8 mm-40 -77.81 -25.04 48.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.8 mp -85.37 -46.26 11.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.409 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.791 HG22 ' HA ' ' A' ' 88' ' ' GLN . 6.3 m -58.62 -32.33 45.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.38 -44.46 75.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 0.0 110.184 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.721 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.7 mp -68.76 -41.97 82.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.274 177.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 65.3 mt -56.98 -49.26 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 0.0 110.026 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -72.52 -36.36 68.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.276 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.44 -45.96 5.97 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.051 -172.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.571 ' SG ' HG23 ' A' ' 93' ' ' ILE . 83.5 m -70.74 -39.86 73.06 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.878 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.6 tm-20 -63.34 -38.23 90.36 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.222 0.465 . . . . 0.0 110.449 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -68.22 -36.04 78.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 110.939 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.3 m -96.69 7.79 45.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 111.272 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.19 144.6 84.82 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.1 -176.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 35.4 Cg_exo -61.14 146.12 97.95 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.347 2.032 . . . . 0.0 110.124 174.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 37.9 Cg_exo -57.07 91.14 0.05 OUTLIER 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.967 2.445 . . . . 0.0 113.256 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -125.97 93.47 3.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 175.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -81.3 63.45 5.63 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 0.0 110.927 -175.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.778 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.3 t70 -124.18 112.36 16.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.213 172.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -34.09 -55.0 0.5 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.7 t -88.19 -30.55 19.66 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.032 0.833 . . . . 0.0 112.294 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.778 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 73.2 mmm -65.28 -36.25 83.5 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 111' ' ' THR . 5.6 ptpt -57.79 -48.39 79.83 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.818 0.818 . . . . 0.0 110.346 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.622 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -57.46 -10.66 1.52 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.602 174.682 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.69 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.1 mp -89.84 -41.36 13.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 4.4 m-20 -59.66 -35.49 74.53 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.362 174.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.581 HG22 ' HA ' ' A' ' 111' ' ' THR . 7.1 m -80.76 -35.49 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.046 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.41 -51.57 68.92 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.337 0.589 . . . . 0.0 111.472 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.701 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.97 -25.17 64.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.251 179.538 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.5 t -68.57 -27.03 65.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.745 175.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.721 ' HB2' HG21 ' A' ' 93' ' ' ILE . 66.3 t80 -74.36 -44.31 52.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.285 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.567 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 1.2 pttp -70.49 -29.72 66.32 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.174 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.701 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.34 -56.18 23.01 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.958 0.409 . . . . 0.0 110.322 169.649 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -61.95 -42.28 98.93 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 175.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.1 -33.67 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 118.488 0.586 . . . . 0.0 111.078 175.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -71.59 -32.22 67.8 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.244 -0.285 . . . . 0.0 111.659 174.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.2 tttt -68.56 -35.84 77.95 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.317 0.58 . . . . 0.0 110.116 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 81.7 mt -76.55 -0.48 23.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.431 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 65.12 177.06 0.2 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-O 121.469 0.652 . . . . 0.0 111.596 -177.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -110.48 120.38 42.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.873 -170.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.39 116.23 66.17 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.292 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.69 137.56 59.55 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.736 2.291 . . . . 0.0 112.488 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -88.07 136.84 32.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 70.1 mtm -68.02 -41.91 81.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.504 0.192 . . . . 0.0 111.011 -174.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.83 -178.34 0.14 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.871 0.732 . . . . 0.0 111.858 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 134' ' ' VAL . 1.3 tm? 178.59 147.67 0.18 Allowed 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 133' ' ' LEU . 5.6 p -56.15 101.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.56 0.695 . . . . 0.0 110.561 177.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.689 ' H ' HD13 ' A' ' 135' ' ' ILE . 0.2 OUTLIER -71.62 18.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.669 -176.478 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.414 ' H ' HG22 ' A' ' 134' ' ' VAL . . . 95.27 89.95 1.74 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.793 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -64.61 133.09 51.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 171.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 51.2 t -44.82 120.61 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 O-C-N 123.969 0.793 . . . . 0.0 111.857 -172.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.87 139.2 38.37 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.145 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -148.64 140.06 23.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.659 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -82.55 -47.31 12.3 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.275 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.111 179.79 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 110.723 -0.103 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.97 -22.55 55.31 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.461 2.107 . . . . 0.0 111.348 177.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.46 -65.98 0.47 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.289 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 4' ' ' ILE . 9.2 tp -72.46 -15.2 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-O 121.126 0.489 . . . . 0.0 111.188 178.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.2 ttt -71.22 -24.94 62.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.91 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -100.33 94.08 6.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.908 174.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -64.12 138.93 58.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.278 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.7 -43.07 84.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.755 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.4 m -62.3 -36.56 82.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.98 -36.88 62.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.011 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.93 -55.82 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.956 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -48.97 -72.41 0.05 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.24 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.36 29.61 46.86 Favored Glycine 0 C--N 1.347 1.141 0 C-N-CA 121.039 -0.6 . . . . 0.0 113.772 -177.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.449 ' H ' HD11 ' A' ' 55' ' ' LEU . 64.8 tttm -85.89 -37.26 19.32 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.14 0.47 . . . . 0.0 110.718 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.589 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.38 56.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.088 0.471 . . . . 0.0 111.314 -177.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.1 ttm -72.38 -38.48 68.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.155 0.502 . . . . 0.0 110.12 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.72 -34.43 74.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.905 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -90.42 -25.35 20.41 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.53 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 12.3 p -74.95 -33.0 61.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.824 ' HA ' HD22 ' A' ' 25' ' ' LEU . 9.9 tptm -57.11 -50.86 71.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.611 172.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -70.3 -42.65 71.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.44 -36.04 82.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.538 0.209 . . . . 0.0 111.339 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 50' ' ' CYS . 11.3 mt -81.03 -3.75 52.86 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.753 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.1 t 65.45 27.83 11.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.811 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.824 HD22 ' HA ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -55.01 119.86 25.34 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.012 176.506 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -75.01 156.86 42.98 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.774 2.316 . . . . 0.0 111.435 174.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.67 ' HA ' HG22 ' A' ' 30' ' ' VAL . 12.6 p-10 -66.73 -22.59 66.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.17 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 p -68.48 -39.76 81.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.0 110.761 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.35 -50.87 42.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.379 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 27' ' ' ASP . 17.3 m -58.9 -33.6 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.393 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -50.45 67.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.499 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.43 -37.14 86.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.313 0.577 . . . . 0.0 110.01 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mt -57.91 -54.83 42.53 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.056 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -74.88 8.99 2.09 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -176.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -63.24 130.96 46.77 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.349 0.522 . . . . 0.0 110.771 -178.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -74.47 -31.68 62.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.142 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 -81.23 118.0 22.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.778 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.518 ' HD3' ' O ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -81.44 72.95 8.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.351 0.596 . . . . 0.0 111.754 -177.207 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.531 ' HB3' ' CD2' ' A' ' 41' ' ' TYR . 18.7 t70 -44.94 -44.64 9.94 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 173.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.51 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 20.6 m-20 75.01 70.9 0.09 Allowed 'General case' 0 C--N 1.35 0.607 0 CA-C-O 121.522 0.677 . . . . 0.0 110.489 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.531 ' CD2' ' HB3' ' A' ' 39' ' ' ASP . 9.1 p90 -117.73 176.68 5.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.455 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 44' ' ' THR . 6.2 t -92.16 121.06 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.444 ' O ' HG21 ' A' ' 112' ' ' ILE . 41.6 ttm -62.25 100.93 0.19 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.519 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 42' ' ' VAL . 67.9 p -99.32 -23.64 15.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -83.82 134.21 34.72 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.5 0.667 . . . . 0.0 111.484 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.795 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 9.5 mpt_? -74.88 -21.87 58.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.465 -175.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' A' ' 25' ' ' LEU . 2.7 mm? -79.5 -13.04 59.83 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.455 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -61.69 1.89 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -41.07 -48.48 4.34 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 114.901 -1.045 . . . . 0.0 114.293 169.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.604 ' HB3' HD13 ' A' ' 23' ' ' LEU . 15.4 m -68.75 -38.86 80.42 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.49 1.145 . . . . 0.0 111.947 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.31 -23.97 67.49 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 48' ' ' ALA . 70.1 mt -61.96 -37.34 78.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 121.264 0.554 . . . . 0.0 110.622 177.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.1 p-10 -132.88 85.47 2.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.803 0.811 . . . . 0.0 110.076 -178.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 24.4 p -119.01 -46.34 2.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.504 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.589 HD11 ' H ' ' A' ' 15' ' ' ALA . 1.5 tt -58.76 -67.07 0.4 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.041 0.448 . . . . 0.0 111.382 -171.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.565 ' HA ' HD12 ' A' ' 59' ' ' LEU . . . -82.04 -14.72 55.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 110.889 -173.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 HG11 ' A' ' 61' ' ' VAL . 1.4 m -83.04 -35.39 25.8 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.527 ' HB3' ' NZ ' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.56 -16.31 49.02 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.199 -0.601 . . . . 0.0 110.069 174.373 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 56' ' ' ALA . 24.9 mt -64.63 -64.99 0.74 Allowed 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 121.164 -0.215 . . . . 0.0 111.206 172.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -174.61 126.2 0.31 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 -177.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.486 HG11 HG23 ' A' ' 57' ' ' THR . 14.6 p 179.89 38.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 122.348 1.07 . . . . 0.0 109.193 -173.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.693 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 25.2 m -105.17 118.56 52.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.198 -172.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -69.37 -56.01 8.96 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.534 175.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.3 Cg_endo -98.28 -142.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 123.537 2.825 . . . . 0.0 113.524 -172.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -72.13 -2.98 20.6 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.866 -174.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.58 -66.22 0.46 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -174.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 7.4 p30 -71.37 153.73 42.1 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.683 -0.759 . . . . 0.0 110.842 178.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 68.47 32.92 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.567 169.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.693 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.7 p80 -74.61 69.18 1.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.864 0.84 . . . . 0.0 110.841 175.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 64.2 t60 -86.95 -60.79 1.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.858 -176.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.52 -53.45 45.85 Favored Glycine 0 N--CA 1.461 0.365 0 C-N-CA 121.223 -0.513 . . . . 0.0 113.096 -175.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -56.05 -34.05 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.633 0.254 . . . . 0.0 111.484 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.479 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -74.61 -33.95 62.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.146 0.498 . . . . 0.0 110.744 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 78' ' ' MET . 23.2 mmmt -79.04 -35.32 42.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.35 -40.2 95.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.004 174.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -59.7 -36.74 77.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.531 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -36.25 75.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.901 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 50.8 mtt -67.78 -33.35 74.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.958 0.409 . . . . 0.0 110.782 -177.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -91.27 -10.54 41.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.026 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -145.72 94.4 2.49 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.541 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.4 -60.92 0.41 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.065 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.3 147.28 26.14 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.133 -0.534 . . . . 0.0 110.474 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 86' ' ' MET . 3.6 m-20 -75.72 146.92 39.74 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 173.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.838 ' HG3' HE21 ' A' ' 88' ' ' GLN . 0.2 OUTLIER -67.53 -47.29 70.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.302 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.15 -39.67 44.17 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.87 169.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.574 ' HB3' ' HB2' ' A' ' 83' ' ' ASP . 0.8 OUTLIER -82.82 -37.88 23.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -173.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.551 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -60.79 -41.03 94.8 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.993 174.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.838 HE21 ' HG3' ' A' ' 84' ' ' GLU . 2.6 mp0 -71.29 -27.21 63.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.653 -173.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -84.77 -22.07 29.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.742 173.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.7 tt -86.12 -42.53 13.81 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.06 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.478 HG13 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -58.76 -32.98 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 122.944 0.498 . . . . 0.0 111.948 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.73 -42.29 97.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.015 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -62.59 -41.49 92.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.012 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.545 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 34.2 mt -56.94 -47.65 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.385 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -67.62 -35.98 79.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.293 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.2 -46.65 5.8 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.183 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.733 ' HB2' HG12 ' A' ' 114' ' ' VAL . 43.7 m -73.4 -35.2 65.82 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.783 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 6.1 mt-10 -66.12 -37.24 85.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.864 0.756 . . . . 0.0 111.029 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -64.02 -42.24 97.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.869 0.366 . . . . 0.0 110.473 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.9 m -100.36 22.62 11.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.208 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.6 156.81 70.47 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.063 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -44.41 141.4 5.22 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.892 2.395 . . . . 0.0 111.819 177.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.02 22.97 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.872 2.381 . . . . 0.0 113.666 -171.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -115.21 94.14 4.6 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -74.31 97.7 3.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.194 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.535 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 8.7 t70 -89.3 115.52 26.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.854 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -29.72 -63.35 0.13 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.18 1.55 . . . . 0.0 113.627 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 9.9 t -96.89 -12.84 22.96 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -175.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.795 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 3.1 mmm -86.75 -26.18 24.32 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -170.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.635 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -54.36 -44.89 72.58 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.076 0.941 . . . . 0.0 110.852 -171.458 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.635 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.8 t -57.84 -13.2 3.92 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.806 -1.543 . . . . 0.0 113.092 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.552 HD12 HG23 ' A' ' 111' ' ' THR . 1.7 mp -91.17 -37.97 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.48 -38.27 77.26 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.79 175.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.733 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -78.95 -36.28 18.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 121.283 0.563 . . . . 0.0 110.265 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.47 -46.83 88.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.645 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.656 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 21.9 ptt? -69.57 -17.61 63.57 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.628 176.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.63 -30.1 64.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.756 0.788 . . . . 0.0 109.071 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -82.06 -39.77 22.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.669 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.6 -24.27 63.64 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 118.833 -1.147 . . . . 0.0 110.279 177.279 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.656 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.16 -54.99 27.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.991 160.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.54 -49.61 76.78 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 178.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.742 HG22 ' HA ' ' A' ' 119' ' ' LYS . 8.7 tt -57.77 -34.44 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 122.009 -0.432 . . . . 0.0 110.961 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -70.45 -29.5 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 177.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -63.04 -34.5 77.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.3 mt -72.04 -11.24 60.67 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.182 173.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 67.49 -162.84 0.22 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.043 0.537 . . . . 0.0 111.986 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -71.32 97.62 1.62 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.622 -172.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 29.4 m -83.25 140.34 42.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.852 173.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 13.6 Cg_exo -69.63 75.83 1.13 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 123.057 2.504 . . . . 0.0 112.395 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.7 OUTLIER -129.61 110.23 11.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.404 178.316 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.632 ' HG2' ' O ' ' A' ' 130' ' ' ASN . 12.7 ptt? 61.99 156.96 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.631 1.172 . . . . 0.0 112.208 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -92.62 -173.59 3.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.415 -175.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -102.31 120.92 41.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 8.5 m -88.56 113.52 25.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.161 0.505 . . . . 0.0 111.489 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.1 mp -83.32 90.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -142.93 69.92 0.42 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.702 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -81.79 -76.93 0.23 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 75.9 t 65.51 117.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.386 0.612 . . . . 0.0 111.062 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.43 16.62 9.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.794 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -153.89 154.99 34.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.312 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -88.44 165.81 14.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.248 0.987 0 O-C-N 124.572 1.17 . . . . 0.0 112.24 179.54 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.59 -21.21 70.39 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.227 2.618 . . . . 0.0 112.512 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.62 -69.19 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.624 179.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -77.83 -10.7 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.075 0.464 . . . . 0.0 111.215 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.503 ' CE ' ' HA ' ' A' ' 5' ' ' MET . 2.6 tpt -65.33 -39.72 92.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.119 0.485 . . . . 0.0 110.065 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -82.41 103.48 12.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.743 174.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -63.74 148.43 49.18 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.46 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.457 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 9.7 mp -58.92 -52.65 64.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.088 -176.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.9 m -63.3 -33.28 75.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.738 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -72.43 -37.27 68.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.556 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -69.35 -54.73 13.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.853 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 24.8 m-85 -44.73 -69.11 0.15 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.646 171.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.73 33.93 63.91 Favored Glycine 0 C--N 1.342 0.899 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.05 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -67.46 -53.6 27.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 117.598 0.699 . . . . 0.0 109.537 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.427 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.79 88.17 1.89 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.106 0.479 . . . . 0.0 111.09 176.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.0 ttm -69.97 -35.53 74.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.09 -36.55 84.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.548 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -89.47 -25.27 21.55 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.687 -0.805 . . . . 0.0 111.452 -172.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.427 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -68.83 -35.69 77.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 170.051 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -61.55 -46.81 88.35 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.922 175.902 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -69.79 -43.62 71.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.867 -176.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -70.58 -33.61 71.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -174.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.663 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 7.0 mt -86.97 -4.5 59.18 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.434 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m 59.09 43.42 17.46 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.359 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 4.3 mm? -49.77 120.62 11.37 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.9 174.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.652 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 12.3 Cg_exo -72.67 154.4 54.49 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 121.941 1.761 . . . . 0.0 110.814 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.704 ' HA ' HG22 ' A' ' 30' ' ' VAL . 15.0 p-10 -64.13 -27.36 69.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.826 -176.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 m -65.93 -36.26 82.87 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.122 0.487 . . . . 0.0 110.381 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.445 HG11 ' CB ' ' A' ' 47' ' ' LEU . 19.9 t -82.35 -41.04 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.476 -176.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.4 m -58.87 -33.19 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.838 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.98 -51.95 53.86 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.539 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.9 -37.2 86.52 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.7 tp -51.48 -51.74 52.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.63 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -67.84 11.56 0.14 Allowed 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.597 HD22 ' HB3' ' A' ' 39' ' ' ASP . 27.5 p-10 -59.67 111.11 1.31 Allowed 'General case' 0 C--N 1.346 0.429 0 CA-C-N 120.522 1.51 . . . . 0.0 111.382 -174.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -95.46 -2.66 48.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.925 0.393 . . . . 0.0 111.249 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 p90 -91.14 160.51 15.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.139 177.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.879 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -73.26 80.23 1.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 122.074 0.94 . . . . 0.0 110.619 176.614 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB3' HD22 ' A' ' 35' ' ' ASN . 4.7 p-10 -44.82 -53.33 7.58 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.9 p30 49.02 33.06 4.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.595 0.758 . . . . 0.0 111.147 -169.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.56 177.37 4.87 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.69 -176.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.4 t -101.71 136.11 35.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.898 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.405 ' HB3' ' HE2' ' A' ' 43' ' ' MET . 51.8 ttp -70.75 101.46 2.1 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -97.72 -40.82 8.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.257 -173.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 47' ' ' LEU . 8.5 t70 -86.44 120.17 27.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.355 0.598 . . . . 0.0 112.052 -173.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.804 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -44.21 -42.28 6.4 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 114.493 -1.23 . . . . 0.0 113.155 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.701 HD22 ' HG2' ' A' ' 46' ' ' ARG . 3.7 mm? -64.67 -19.47 65.75 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 122.262 -0.274 . . . . 0.0 111.45 -175.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.531 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.08 -59.79 2.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -178.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.54 -47.46 2.95 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-N 115.097 -0.956 . . . . 0.0 114.467 166.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HB3' HD13 ' A' ' 23' ' ' LEU . 30.0 m -63.41 -43.76 96.6 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.489 1.144 . . . . 0.0 111.22 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.52 -23.79 66.29 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.531 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.0 mm -63.86 -34.24 66.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.108 0.48 . . . . 0.0 110.594 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -140.1 63.18 1.48 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.187 0.518 . . . . 0.0 111.277 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.431 ' CB ' HD11 ' A' ' 23' ' ' LEU . 28.7 p -114.54 -38.65 3.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 177.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.3 tt -62.72 -55.63 24.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.551 -170.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.1 -13.69 58.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.079 0.466 . . . . 0.0 110.42 -173.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.509 HG23 HG11 ' A' ' 61' ' ' VAL . 36.7 m -82.97 -35.89 25.56 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.54 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.449 ' HB3' ' NZ ' ' A' ' 58' ' ' LYS . 9.0 mtpm? -81.53 -16.03 53.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.265 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.2 mt -65.62 -65.32 0.69 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.255 170.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -175.7 121.31 0.19 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.706 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.509 HG11 HG23 ' A' ' 57' ' ' THR . 11.5 p -177.28 36.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.477 1.132 . . . . 0.0 109.12 -178.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.593 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.2 m -103.88 117.52 49.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.42 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -54.41 7.54 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.956 177.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -96.41 -145.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.911 2.407 . . . . 0.0 112.906 -173.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.468 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.1 m-20 -76.71 10.14 2.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.376 -176.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.72 -69.56 0.52 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.683 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.2 p30 -69.12 149.42 48.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.712 -0.744 . . . . 0.0 111.36 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 68' ' ' LEU . 4.0 mm? 69.7 31.69 3.5 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.593 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 16.5 p-80 -74.74 68.86 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.314 0.578 . . . . 0.0 110.878 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -86.39 -49.02 7.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.926 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.15 -53.7 43.54 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.582 -174.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -62.01 -27.67 69.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -36.64 73.22 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.672 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -80.03 -35.65 36.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.74 -37.58 88.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.402 173.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -63.07 -35.96 81.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.172 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.23 -37.05 74.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 81.0 mtp -74.44 -39.01 62.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.358 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -82.98 -12.34 57.38 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.804 0.335 . . . . 0.0 110.292 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -144.4 94.56 2.58 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.342 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.83 -64.94 0.47 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.046 -1.073 . . . . 0.0 113.428 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.23 138.34 41.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.032 0.444 . . . . 0.0 111.833 -175.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.612 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -84.05 174.46 10.27 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 172.246 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 30.1 mt-10 -62.22 -35.38 78.72 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.47 -167.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.798 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 12.7 t -61.76 -38.37 87.75 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.751 -177.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 65.4 mtm -81.32 -39.38 25.24 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -174.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.58 -39.74 89.17 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.279 173.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.73 -26.4 60.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.709 -177.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.798 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.7 mm-40 -78.46 -23.56 46.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.619 177.045 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.642 ' O ' HG13 ' A' ' 94' ' ' ILE . 3.4 mm? -85.26 -49.04 8.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.961 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 88' ' ' GLN . 19.9 m -57.99 -39.39 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -172.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.14 -43.06 71.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.869 0.366 . . . . 0.0 110.536 -176.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.762 HG23 ' SG ' ' A' ' 97' ' ' CYS . 3.2 mm -63.43 -42.12 95.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.335 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.686 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.8 mt -51.55 -47.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.622 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.1 m170 -70.87 -36.46 72.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.166 0.508 . . . . 0.0 110.639 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.55 -49.5 4.6 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.334 -172.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.773 ' HB2' HG12 ' A' ' 114' ' ' VAL . 57.9 m -71.39 -35.76 71.16 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.867 -177.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.686 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 1.3 mt-10 -63.92 -37.73 88.48 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.603 0.638 . . . . 0.0 110.88 172.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.22 -35.87 82.21 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.041 0.448 . . . . 0.0 110.546 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.5 m -107.43 25.51 11.36 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -87.32 149.64 47.41 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -175.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.16 149.24 81.6 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.364 2.043 . . . . 0.0 110.288 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -66.45 71.87 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.857 2.372 . . . . 0.0 113.146 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -99.73 91.66 4.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -81.2 77.27 8.11 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.962 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.723 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.7 t70 -145.3 128.43 16.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.733 174.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HE2' ' HB3' ' A' ' 107' ' ' LYS . 13.4 ttpt -29.25 -55.87 0.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 125.024 1.453 . . . . 0.0 114.508 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.444 ' CB ' ' HB2' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -93.72 -16.97 23.69 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.519 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 90.3 mmm -74.3 -32.14 62.76 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 121.841 -0.537 . . . . 0.0 111.731 -172.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.723 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -62.71 -49.53 74.71 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.692 0.758 . . . . 0.0 109.853 178.013 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.723 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.06 -14.21 6.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.468 175.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.501 ' O ' ' HG2' ' A' ' 116' ' ' MET . 0.5 OUTLIER -89.27 -39.71 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 12.2 t70 -62.94 -35.38 79.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.484 177.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.773 HG12 ' HB2' ' A' ' 97' ' ' CYS . 15.8 m -79.42 -38.15 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.025 0.441 . . . . 0.0 110.168 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.44 -49.1 78.92 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-O 121.544 0.688 . . . . 0.0 111.304 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.512 ' HA ' ' HD3' ' A' ' 119' ' ' LYS . 25.0 ptt? -69.58 -19.85 63.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.06 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.863 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 8.5 t -72.79 -24.17 60.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.482 ' HE1' ' HB3' ' A' ' 89' ' ' GLN . 57.6 t80 -77.76 -40.58 40.41 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.424 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.2 pttp -67.82 -29.62 68.82 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 118.725 -1.19 . . . . 0.0 110.348 176.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.863 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.99 -54.62 44.89 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.625 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.45 ' HG3' HD11 ' A' ' 93' ' ' ILE . 14.4 mm-40 -58.71 -52.03 67.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.844 176.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -54.91 -36.63 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -70.86 -32.15 69.07 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.302 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -71.18 -33.94 70.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.214 0.53 . . . . 0.0 110.393 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 90.2 mt -66.23 -33.79 76.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.546 173.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 125' ' ' LEU . 53.4 m-80 75.92 123.44 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.583 0.753 . . . . 0.0 111.912 177.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 26.0 m95 50.04 -158.15 0.08 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.061 177.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.601 HG22 ' H ' ' A' ' 130' ' ' ASN . 7.6 p -131.46 129.14 22.13 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.087 -175.187 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 2.8 Cg_exo -76.69 15.81 1.02 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.545 2.83 . . . . 0.0 112.968 -179.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.601 ' H ' HG22 ' A' ' 128' ' ' VAL . 22.2 t-20 -115.99 125.9 53.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.239 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 44.8 mtm -98.36 102.58 14.37 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.323 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -102.77 105.35 15.76 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.144 0.497 . . . . 0.0 110.285 175.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 46.8 tp -65.22 -30.02 70.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.404 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 134' ' ' VAL . 2.7 m -65.92 117.35 6.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.45 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.415 ' H ' HD12 ' A' ' 135' ' ' ILE . 0.5 OUTLIER -117.51 115.94 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.229 -178.616 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -55.57 133.63 49.64 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.67 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -66.11 139.79 58.18 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.4 p -137.58 141.25 39.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.878 0.371 . . . . 0.0 110.83 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.563 HD22 ' H ' ' A' ' 141' ' ' GLU . 0.5 OUTLIER -118.31 129.08 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 177.85 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -83.46 -14.47 52.43 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.563 ' H ' HD22 ' A' ' 139' ' ' LEU . 46.3 mt-10 -105.23 149.82 25.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 0.0 110.967 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.4 m . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.281 179.203 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 120.828 0.347 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 98.5 Cg_endo -83.73 -0.94 9.91 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.742 2.294 . . . . 0.0 112.515 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -51.1 -70.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.784 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -78.98 -9.48 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 121.149 0.499 . . . . 0.0 111.183 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 26.0 ttt -71.48 -30.09 65.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.33 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HA ' ' HE3' ' A' ' 6' ' ' LYS . 1.8 tpmt? -89.28 103.84 16.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.768 176.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.586 ' HB2' ' HB3' ' A' ' 10' ' ' ASN . 6.3 m120 -84.85 127.57 34.21 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.771 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.3 mp -60.13 -52.99 63.0 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -176.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -64.57 -26.83 68.58 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.447 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.586 ' HB3' ' HB2' ' A' ' 7' ' ' ASN . 27.9 t-20 -75.62 -34.31 60.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.494 177.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -74.5 -55.4 5.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.943 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -50.08 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.94 45.28 81.5 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 120.669 -0.777 . . . . 0.0 113.051 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.53 -60.24 3.95 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.829 0.347 . . . . 0.0 110.988 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -150.5 93.76 2.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.54 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 ttp -74.07 -31.01 62.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.68 -30.42 63.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.252 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -88.06 -26.21 22.66 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.037 -175.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 82.8 m -75.71 -31.04 59.49 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 170.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 1.029 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 23.4 tptp -56.18 -50.11 72.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.327 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.775 -178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -69.74 -37.29 76.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -173.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.888 ' HB2' HD12 ' A' ' 25' ' ' LEU . 16.0 mt -86.22 -6.28 59.01 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.132 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.7 t 59.53 43.82 15.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.435 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.029 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 10.3 mp -50.14 124.87 18.14 Favored Pre-proline 0 N--CA 1.47 0.559 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.313 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.582 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 11.1 Cg_exo -71.86 151.26 56.73 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.256 1.971 . . . . 0.0 110.072 170.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 30' ' ' VAL . 1.5 p30 -66.29 -26.01 67.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.847 0.356 . . . . 0.0 111.218 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 p -65.76 -32.91 74.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.07 0.462 . . . . 0.0 110.7 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.492 HG11 ' HB2' ' A' ' 47' ' ' LEU . 23.8 t -79.04 -42.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.37 -177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 27' ' ' ASP . 34.8 m -59.61 -29.22 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.126 0.489 . . . . 0.0 109.745 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.65 -52.71 41.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.6 176.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.97 -36.31 81.91 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.323 0.583 . . . . 0.0 109.747 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.8 tp -47.09 -55.67 7.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.253 173.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -66.58 10.07 0.14 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -65.78 116.18 6.7 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 120.393 1.451 . . . . 0.0 109.895 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -78.26 -28.79 47.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.289 -176.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -82.66 98.08 8.85 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -174.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -91.35 67.5 5.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.984 -174.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -63.47 13.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.06 70.47 0.65 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 119.087 0.858 . . . . 0.0 110.096 -169.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -103.05 171.07 7.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.574 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.8 t -90.67 113.56 26.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.211 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.553 ' O ' HG21 ' A' ' 112' ' ' ILE . 40.4 ttm -79.25 95.5 5.67 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.809 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.1 p -93.22 -18.0 23.03 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -84.88 133.81 34.3 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.811 0.815 . . . . 0.0 110.517 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HE ' ' CG ' ' A' ' 106' ' ' ASP . 9.9 mpt_? -68.98 -31.49 70.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.084 -1.416 . . . . 0.0 109.769 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.582 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.4 mm? -75.11 -14.88 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.04 -58.29 2.75 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.453 ' O ' HG22 ' A' ' 52' ' ' ILE . . . -38.64 -45.01 1.91 Allowed Glycine 0 CA--C 1.534 1.261 0 CA-C-N 114.919 -1.037 . . . . 0.0 114.655 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.446 ' HB3' HD13 ' A' ' 23' ' ' LEU . 4.1 m -76.24 -44.92 35.27 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.473 1.136 . . . . 0.0 112.247 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.4 -23.87 63.78 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 49' ' ' GLY . 14.7 tt -71.72 -19.86 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 0.0 110.945 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -144.08 85.24 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.229 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 23.9 t -121.76 -45.24 2.29 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.55 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.433 ' H ' HD22 ' A' ' 55' ' ' LEU . 3.2 mm? -58.25 -49.07 78.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.97 0.414 . . . . 0.0 111.51 -174.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.53 -15.67 51.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.962 0.41 . . . . 0.0 110.921 -174.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -83.78 -34.63 24.72 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.396 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 43.2 mtpt -82.92 -12.92 56.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.199 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.27 -64.09 0.95 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.888 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -175.05 111.7 0.13 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.467 HG12 ' O ' ' A' ' 57' ' ' THR . 8.1 p -176.0 32.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-O 121.327 0.584 . . . . 0.0 111.497 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.583 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.8 m -109.65 117.58 54.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.28 -0.888 . . . . 0.0 111.659 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 69' ' ' HIS . 0.1 OUTLIER -65.73 -59.68 8.75 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.485 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.714 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 27.6 Cg_endo -104.87 -139.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.52 2.813 . . . . 0.0 112.607 -171.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.472 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -72.13 -0.3 11.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.153 -177.652 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.78 -75.7 0.27 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.995 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.714 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p30 -70.06 152.68 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.084 -0.558 . . . . 0.0 111.637 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.6 mm? 70.98 27.67 3.34 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.504 0.722 . . . . 0.0 112.325 174.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ASP . 4.4 p80 -74.65 68.12 1.62 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 111.119 171.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -87.49 -31.66 19.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.395 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.6 -63.33 3.77 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.953 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 7.9 m-80 -55.26 -25.43 33.66 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 122.913 0.485 . . . . 0.0 112.087 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.27 -38.09 75.01 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.38 0.61 . . . . 0.0 110.291 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.511 ' HE3' HD13 ' A' ' 94' ' ' ILE . 59.9 mmtt -81.5 -36.43 29.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.762 177.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.598 ' HB3' ' HA ' ' A' ' 72' ' ' ASN . 11.2 t70 -60.58 -40.67 92.58 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.361 174.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -60.83 -42.41 97.69 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.443 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.39 -30.25 68.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.434 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.473 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 84.7 mtp -74.23 -40.88 62.12 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.614 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 13.6 ptpt -94.28 -7.89 40.65 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.456 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.771 ' HB3' HD21 ' A' ' 8' ' ' LEU . 42.5 m-70 -139.91 90.82 2.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.36 176.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.38 -75.74 0.42 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.646 173.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -96.91 149.8 21.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.511 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.2 OUTLIER -84.37 169.4 14.65 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 173.092 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -67.05 -38.22 85.46 Favored 'General case' 0 N--CA 1.411 -2.405 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.148 -168.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.761 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.7 OUTLIER -62.21 -33.51 74.69 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.08 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 7.4 tpt -84.56 -39.98 18.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.493 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.98 -38.97 77.05 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.535 172.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.553 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -71.67 -23.83 61.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.197 -178.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.761 ' HG2' ' O ' ' A' ' 85' ' ' THR . 9.0 mm-40 -77.21 -25.75 52.05 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.1 tp -86.95 -44.91 11.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.274 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.553 HG22 ' HA ' ' A' ' 88' ' ' GLN . 26.7 m -57.36 -34.46 46.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.281 -175.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.69 -44.07 78.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -65.46 -41.06 90.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.854 175.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.511 HD13 ' HE3' ' A' ' 74' ' ' LYS . 86.4 mt -55.45 -48.24 77.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.681 -177.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -72.28 -35.26 68.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.897 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.9 -43.71 7.52 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.879 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 93' ' ' ILE . 63.0 m -72.79 -34.54 66.98 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 121.398 -0.121 . . . . 0.0 110.789 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -57.41 -38.38 74.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.819 0.343 . . . . 0.0 110.732 170.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -64.77 -43.23 93.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.168 175.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.1 m -99.0 25.17 6.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.841 0.353 . . . . 0.0 111.745 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 102' ' ' PRO . . . -76.09 148.21 81.04 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.606 178.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 23.9 Cg_exo -64.42 151.38 85.73 Favored 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.672 2.248 . . . . 0.0 111.871 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.4 Cg_exo -70.55 59.3 2.01 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -121.61 116.72 25.13 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -81.12 93.17 6.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.919 0.39 . . . . 0.0 111.249 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.732 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 6.2 m-20 -130.03 97.65 4.53 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.318 0.58 . . . . 0.0 110.152 170.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -42.65 -49.05 5.58 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 176.321 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.06 -24.14 28.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.871 1.214 . . . . 0.0 112.16 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.732 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 2.4 mmm -85.54 -26.72 26.02 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.48 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.1 OUTLIER -56.78 -45.95 81.8 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.737 0.779 . . . . 0.0 111.311 -170.46 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.56 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -57.93 -14.06 5.62 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.288 177.363 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.553 HG21 ' O ' ' A' ' 43' ' ' MET . 3.7 mp -90.13 -37.14 9.21 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 176.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -60.09 -35.31 74.93 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.518 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 111' ' ' THR . 16.5 m -81.26 -34.97 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.79 84.44 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.243 0.544 . . . . 0.0 111.653 174.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.573 ' HA ' ' CE ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.523 179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.516 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 43.2 t -73.02 -23.12 60.57 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.863 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.8 t80 -79.76 -46.56 16.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.573 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.17 -25.21 64.24 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 118.499 -1.28 . . . . 0.0 109.345 177.6 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.561 ' HE3' ' O ' ' A' ' 116' ' ' MET . 3.5 ttmt -54.02 -55.69 24.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.166 169.297 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 27.4 mm-40 -59.11 -40.52 85.62 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.509 173.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.544 HD13 HD12 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -57.23 -35.23 47.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 118.467 0.576 . . . . 0.0 111.349 176.949 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -72.46 -31.67 65.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.115 0.484 . . . . 0.0 111.135 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -71.0 -22.35 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.556 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.544 HD12 HD13 ' A' ' 122' ' ' ILE . 96.6 mt -71.05 5.48 2.04 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.727 176.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 10.5 p30 46.82 -160.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.337 1.055 . . . . 0.0 112.57 -178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -75.25 -60.73 2.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 -174.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.62 145.53 0.1 Allowed Pre-proline 0 CA--C 1.537 0.452 0 O-C-N 123.94 0.775 . . . . 0.0 110.971 -176.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -63.6 100.36 0.28 Allowed 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.231 1.954 . . . . 0.0 111.246 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -90.77 170.41 10.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.377 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 25.2 ptm -93.38 150.21 20.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.084 -176.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -83.92 162.02 20.63 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 175.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 27.7 tp -129.15 46.27 2.66 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.46 112.27 18.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.548 179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.9 mp -80.22 133.14 30.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.063 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -69.82 89.02 0.3 Allowed Glycine 0 N--CA 1.451 -0.342 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 174.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.03 140.78 55.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 122.617 0.367 . . . . 0.0 111.75 -173.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.4 p -54.54 139.7 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.831 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 10.5 tt -101.27 -26.89 13.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.47 178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.48 124.83 22.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.035 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -130.71 -70.53 0.61 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.791 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.355 -0.831 . . . . 0.0 109.901 178.719 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.471 0.594 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.483 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.3 Cg_exo -58.18 -21.75 53.16 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.044 2.496 . . . . 0.0 112.518 -178.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -49.25 -68.25 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.823 177.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.8 tp -78.15 -14.3 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.115 0.483 . . . . 0.0 111.447 -177.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.483 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.7 mmm -80.15 -21.43 43.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.5 tttp -90.56 114.11 26.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -88.99 135.04 33.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.457 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.7 mp -58.03 -48.15 80.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.173 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.5 m -60.83 -37.02 80.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.004 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -70.54 -37.22 74.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.841 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -72.09 -56.75 5.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.406 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -58.7 -79.94 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.95 42.08 69.49 Favored Glycine 0 C--N 1.344 0.99 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.726 -171.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -81.9 -36.98 27.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.211 0.529 . . . . 0.0 110.528 -176.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.06 55.74 1.38 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.574 0.702 . . . . 0.0 109.638 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.445 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 53.9 tpp -69.77 -37.71 76.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.709 -177.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -54.09 -38.07 64.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.594 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 30.2 mt-30 -90.67 -27.24 19.14 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.346 -0.542 . . . . 0.0 111.67 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 9.1 p -76.83 -33.04 57.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.777 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 8.9 tptp -57.91 -49.69 75.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.75 172.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.91 -39.94 72.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.393 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 3.2 tm-20 -68.57 -39.27 81.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.201 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -77.37 -4.71 46.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.122 0.487 . . . . 0.0 110.385 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.2 m 65.43 36.3 6.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.504 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.777 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 18.2 mt -65.07 120.09 64.18 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.786 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.581 ' CD ' HD21 ' A' ' 47' ' ' LEU . 7.9 Cg_exo -73.95 163.41 36.96 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.838 2.359 . . . . 0.0 110.444 171.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -62.34 -32.32 73.07 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.408 -174.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -63.95 -52.9 57.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 111.447 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.662 HG21 HD23 ' A' ' 47' ' ' LEU . 59.1 t -70.14 -53.38 23.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.75 -175.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.455 HG22 ' CE2' ' A' ' 34' ' ' TYR . 9.9 p -59.9 -30.01 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.007 -176.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.84 -51.48 40.04 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.05 -34.58 78.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.661 0.743 . . . . 0.0 109.388 178.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -53.82 -38.73 64.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.612 171.214 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.455 ' CE2' HG22 ' A' ' 30' ' ' VAL . 19.6 m-85 -76.28 9.13 2.76 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -65.4 108.01 1.83 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.915 0.78 . . . . 0.0 109.89 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -71.27 -33.57 69.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.732 -175.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 25.9 m-90 -74.13 126.84 31.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.468 0.652 . . . . 0.0 110.294 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.814 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -75.99 69.9 2.64 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.808 -178.711 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.636 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 29.1 t70 -43.62 -23.96 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 176.06 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.1 t0 67.32 71.4 0.36 Allowed 'General case' 0 C--N 1.351 0.637 0 CA-C-N 118.97 0.804 . . . . 0.0 109.553 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.636 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.2 p90 -124.19 169.84 11.33 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.758 -177.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -90.21 132.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 35.9 ttp -68.95 93.19 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.477 0.656 . . . . 0.0 109.621 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.9 p -88.33 -40.65 13.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.737 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.585 ' OD2' ' HB3' ' A' ' 47' ' ' LEU . 24.1 t70 -80.96 117.74 21.84 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 122.246 1.022 . . . . 0.0 111.059 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.724 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.33 -37.39 62.27 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.066 -1.879 . . . . 0.0 111.792 172.69 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.662 HD23 HG21 ' A' ' 29' ' ' VAL . 28.3 tp -71.27 -18.06 62.44 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 -173.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.42 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -51.87 8.13 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.95 -46.03 1.7 Allowed Glycine 0 CA--C 1.531 1.073 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.212 165.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.9 m -68.87 -43.42 75.39 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.393 1.097 . . . . 0.0 109.596 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.58 -9.47 58.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.354 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 48' ' ' ALA . 55.9 mt -59.22 -36.17 61.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.05 0.452 . . . . 0.0 110.282 175.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -135.47 84.77 2.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.3 p -102.26 -45.51 5.1 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.9 -178.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 59' ' ' LEU . 61.9 tp -60.64 -57.02 14.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.267 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.22 -15.69 54.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.009 0.433 . . . . 0.0 110.762 -170.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.605 HG23 HG11 ' A' ' 61' ' ' VAL . 96.0 m -74.79 -34.0 62.35 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.556 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 14.8 mmmt -79.36 -25.85 42.16 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.435 177.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.1 mm? -65.42 -64.29 0.9 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.846 172.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -176.27 117.17 0.13 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.691 0.282 . . . . 0.0 110.776 -175.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG23 ' A' ' 57' ' ' THR . 11.2 p -166.43 32.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.239 1.019 . . . . 0.0 109.338 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.715 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 35.5 m -111.28 120.68 62.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.176 -174.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.19 -56.15 2.04 Favored Pre-proline 0 CA--C 1.533 0.318 0 O-C-N 122.277 -0.264 . . . . 0.0 111.43 175.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 10.9 Cg_endo -97.04 -146.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.155 2.57 . . . . 0.0 112.682 -173.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.411 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -74.56 11.76 0.94 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.788 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.77 -68.88 0.54 Allowed Glycine 0 C--N 1.317 -0.49 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.316 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.8 p30 -70.0 149.5 47.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.43 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 68.69 31.73 4.45 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 173.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.715 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 13.3 p80 -73.9 72.6 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.583 0.706 . . . . 0.0 111.669 176.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -87.34 -47.52 8.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.044 -179.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.63 -59.07 11.51 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.89 -173.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -63.28 -24.18 67.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.29 -36.51 68.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.221 0.534 . . . . 0.0 110.378 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HZ1' ' HB1' ' A' ' 87' ' ' ALA . 3.1 mmmp? -79.91 -33.37 39.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.891 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 20.9 t70 -64.23 -42.1 96.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.084 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -63.89 -39.52 94.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.82 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.7 -33.7 72.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.164 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 68.7 mtm -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.961 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 3.7 ptpp? -93.16 -14.16 27.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.867 -0.733 . . . . 0.0 111.583 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.868 ' HB3' HD21 ' A' ' 8' ' ' LEU . 35.4 m80 -139.08 92.64 2.61 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.403 178.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.27 -75.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.579 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.22 146.22 30.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.579 0.228 . . . . 0.0 110.559 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.686 ' OD1' HG22 ' A' ' 85' ' ' THR . 2.5 p30 -87.54 174.71 8.31 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.343 0.592 . . . . 0.0 110.643 173.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -49.46 69.95 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.56 -166.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.76 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.1 t -62.76 -32.27 73.39 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.465 -175.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 72.0 mtp -79.59 -39.46 31.65 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.447 0.641 . . . . 0.0 109.53 -173.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.507 ' HB1' ' HZ1' ' A' ' 74' ' ' LYS . . . -63.14 -31.64 72.84 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.507 176.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.822 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -82.35 -19.61 38.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.8 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.76 ' HG2' ' O ' ' A' ' 85' ' ' THR . 75.4 mm-40 -78.58 -23.68 45.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 94' ' ' ILE . 24.9 tp -85.98 -43.86 12.82 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.006 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.822 HG22 ' HA ' ' A' ' 88' ' ' GLN . 2.8 m -57.67 -29.73 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -175.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -68.08 -43.02 79.51 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.265 0.555 . . . . 0.0 109.865 -178.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.625 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.01 -42.05 85.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.058 175.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.645 HG13 ' O ' ' A' ' 90' ' ' LEU . 27.2 mt -54.95 -47.59 76.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 CA-C-O 120.921 0.391 . . . . 0.0 110.174 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -70.22 -37.07 74.95 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.826 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.94 -48.39 5.2 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.277 -173.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.807 ' HB2' HG12 ' A' ' 114' ' ' VAL . 39.7 m -72.98 -37.42 67.05 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -67.36 -37.36 83.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 117.969 0.349 . . . . 0.0 110.494 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.34 -33.4 75.77 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.814 0.34 . . . . 0.0 110.577 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.7 m -97.73 8.11 45.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.324 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.24 155.51 79.44 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.885 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.512 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 59.6 Cg_exo -52.88 138.21 60.85 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.75 2.3 . . . . 0.0 111.977 176.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.7 Cg_exo -71.28 35.1 0.27 Allowed 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.592 2.861 . . . . 0.0 113.208 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -95.94 119.47 34.49 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.97 96.03 4.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.435 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.943 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.5 t70 -144.38 119.03 9.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.346 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -29.92 -71.83 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.074 1.484 . . . . 0.0 113.776 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.42 ' O ' HD13 ' A' ' 112' ' ' ILE . 81.6 m -88.79 -14.72 36.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -174.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.943 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -63.12 -42.62 99.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.703 0.683 . . . . 0.0 110.453 -178.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.668 ' HG3' ' H ' ' A' ' 111' ' ' THR . 0.6 OUTLIER -64.44 -49.97 69.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.651 0.738 . . . . 0.0 110.422 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.668 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -59.04 -13.4 6.6 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.913 175.777 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -88.3 -35.86 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.625 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.2 OUTLIER -59.81 -37.56 79.5 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.046 173.254 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.807 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.7 m -78.02 -38.29 24.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.733 178.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.07 -52.59 64.71 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 121.006 0.432 . . . . 0.0 111.739 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.648 ' SD ' ' HE2' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.4 -24.68 63.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.58 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.92 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 13.8 t -69.09 -25.43 64.42 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.594 0.712 . . . . 0.0 110.142 176.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.609 ' HA ' HG12 ' A' ' 93' ' ' ILE . 75.1 t80 -79.81 -43.09 23.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.133 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.6 pttp -68.12 -28.1 67.04 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.736 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.92 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.42 -54.95 41.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.709 0.29 . . . . 0.0 111.008 173.211 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HG3' ' N ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -59.52 -47.59 84.94 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.346 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.542 ' N ' ' HG3' ' A' ' 121' ' ' GLU . 1.9 tt -59.85 -31.24 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 120.932 0.396 . . . . 0.0 110.943 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -70.6 -30.86 67.65 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 176.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -36.15 69.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.54 -38.49 77.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.407 174.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 65.3 t30 52.24 -110.09 0.49 Allowed 'General case' 0 CA--C 1.531 0.22 0 O-C-N 123.51 0.506 . . . . 0.0 109.731 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -138.16 135.13 35.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 169.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.7 t 62.62 83.09 0.21 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 110.708 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -88.43 119.89 1.19 Allowed 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.835 2.356 . . . . 0.0 111.764 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -94.96 106.41 18.39 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.168 0.508 . . . . 0.0 110.951 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 61.1 mtt -81.73 141.08 33.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.316 176.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -85.16 127.14 34.15 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.424 -176.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.8 tp -83.01 83.22 7.91 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.26 0.552 . . . . 0.0 109.971 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 47.6 t -81.51 137.78 20.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.538 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -143.49 98.91 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.362 0.601 . . . . 0.0 110.874 -178.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -87.31 160.67 32.07 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.355 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -106.89 151.1 25.7 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.9 m -116.33 105.0 17.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.462 0.648 . . . . 0.0 111.218 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.77 HD23 ' H ' ' A' ' 139' ' ' LEU . 0.6 OUTLIER -86.42 102.2 13.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.032 178.002 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -90.22 112.19 23.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.623 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.16 116.35 20.21 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.097 177.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 C--O 1.249 1.062 0 CA-C-O 117.876 -1.059 . . . . 0.0 112.542 -178.296 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.424 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 66.8 m . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 120.581 0.229 . . . . 0.0 110.801 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 24.9 Cg_endo -63.34 -21.36 71.59 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.416 2.077 . . . . 0.0 111.738 177.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 15.7 mp0 -49.93 -69.56 0.11 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.934 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -78.19 -12.94 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.05 0.453 . . . . 0.0 111.495 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 74.5 mmm -79.5 -21.83 44.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 110.958 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -89.11 103.84 16.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.967 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -62.44 136.17 57.78 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.916 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.683 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.5 pt? -56.4 -42.96 78.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.843 178.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.763 ' HB3' HD13 ' A' ' 55' ' ' LEU . 50.8 m -61.44 -30.28 70.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -74.7 -31.66 61.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.083 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -75.6 -49.36 18.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.145 176.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -46.7 -74.2 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 172.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.3 46.04 87.35 Favored Glycine 0 C--N 1.34 0.751 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.661 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.604 ' H ' HD23 ' A' ' 55' ' ' LEU . 87.9 tttt -67.76 -62.03 1.6 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 117.057 0.429 . . . . 0.0 110.987 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.87 102.83 3.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.551 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.4 mmt -70.65 -25.29 62.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.17 0.51 . . . . 0.0 110.168 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.45 -31.11 70.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.777 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -88.87 -25.63 22.05 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.85 -170.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 99.7 m -74.25 -34.58 63.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.189 0.519 . . . . 0.0 109.764 173.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -62.2 -47.29 85.12 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.893 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -76.14 -48.15 21.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.678 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.82 -32.3 72.75 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -174.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.583 ' CB ' HD13 ' A' ' 25' ' ' LEU . 4.1 mm? -88.9 -17.42 29.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.667 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 60.61 36.25 19.77 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -170.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.71 HD23 HG12 ' A' ' 30' ' ' VAL . 2.0 tp -57.08 121.81 49.06 Favored Pre-proline 0 N--CA 1.456 -0.138 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.801 -172.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 17.9 Cg_exo -68.54 155.67 68.22 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.694 2.263 . . . . 0.0 110.804 173.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.697 ' HA ' HG22 ' A' ' 30' ' ' VAL . 52.7 p30 -70.9 -20.53 62.49 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.587 -175.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 m -66.38 -37.52 85.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 109.876 173.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG21 ' HD2' ' A' ' 26' ' ' PRO . 61.7 t -73.58 -51.43 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.885 -177.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.71 HG12 HD23 ' A' ' 25' ' ' LEU . 35.5 m -57.42 -36.31 52.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 120.937 0.399 . . . . 0.0 110.931 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.62 -51.71 57.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.731 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.14 -25.25 60.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.144 0.497 . . . . 0.0 110.167 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.6 tp -56.59 -52.75 63.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.406 174.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -74.57 10.04 1.52 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -65.36 126.21 27.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.852 0.751 . . . . 0.0 111.184 -175.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -82.87 -35.05 26.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.349 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -72.73 134.25 44.92 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.005 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -77.54 67.76 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.217 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -43.69 -54.71 4.87 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 171.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.0 t70 64.63 70.35 0.49 Allowed 'General case' 0 C--N 1.347 0.472 0 CA-C-O 121.699 0.762 . . . . 0.0 109.919 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -125.59 178.66 5.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.158 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 62.0 t -83.69 128.88 38.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 51.0 ttm -68.03 92.44 0.38 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.253 0.549 . . . . 0.0 109.669 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.1 p -92.12 -32.63 15.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.493 -174.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.44 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 13.7 t70 -70.87 129.84 40.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.401 0.62 . . . . 0.0 111.227 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.402 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 1.6 mpt_? -75.2 -20.88 59.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.296 -175.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 25' ' ' LEU . 3.4 mm? -78.34 -15.73 58.42 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.109 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.0 -62.49 1.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -177.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.714 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -41.3 -48.12 4.55 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 114.845 -1.071 . . . . 0.0 114.475 169.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.3 m -66.97 -42.63 84.81 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.541 1.171 . . . . 0.0 111.794 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.01 -18.83 65.6 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 48' ' ' ALA . 46.3 mm -54.67 -40.25 50.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.277 175.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -118.6 77.15 1.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.024 177.226 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 t -125.28 -46.72 1.77 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.278 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 9' ' ' SER . 7.5 mp -66.77 -74.95 0.1 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.413 0.625 . . . . 0.0 111.743 -170.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.14 -3.22 54.41 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.326 0.584 . . . . 0.0 110.069 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.527 ' HA ' HG11 ' A' ' 61' ' ' VAL . 81.1 m -83.63 -35.99 24.2 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.354 173.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.1 mtpt -77.49 -15.52 59.25 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.056 172.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 tp -64.94 -66.41 0.55 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.529 172.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 22.2 t70 -176.22 121.26 0.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.5 p -179.47 43.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.622 0.725 . . . . 0.0 111.655 -176.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.576 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.3 m -105.97 121.46 58.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 110.366 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -64.55 -55.21 31.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.794 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.5 Cg_endo -97.72 -138.85 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.233 2.622 . . . . 0.0 113.298 -172.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -71.28 -5.51 32.79 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.226 -173.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 140.27 -56.75 0.61 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -170.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.6 p-10 -84.32 149.47 26.03 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.085 -0.557 . . . . 0.0 111.029 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.46 46.43 1.03 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.34 0.591 . . . . 0.0 110.799 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -75.14 81.42 2.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.534 0.683 . . . . 0.0 111.32 178.678 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -86.0 -63.25 1.35 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.232 -175.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.32 -60.27 8.88 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 121.278 -0.487 . . . . 0.0 113.05 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.409 ' HA ' HD21 ' A' ' 72' ' ' ASN . 0.6 OUTLIER -55.49 -29.04 58.06 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.453 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.29 -37.18 66.32 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.056 0.455 . . . . 0.0 110.919 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 78' ' ' MET . 72.6 mmtt -79.33 -33.67 42.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.04 -39.98 95.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.379 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.507 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 42.4 t80 -63.65 -32.51 74.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.396 177.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.71 -32.94 71.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.651 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 55.0 mtt -69.39 -28.12 65.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.859 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 76' ' ' PHE . 49.3 mtmt -86.31 -15.65 39.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.065 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -145.58 96.0 2.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.664 0.269 . . . . 0.0 111.199 -176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.08 -62.99 0.51 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.396 -0.906 . . . . 0.0 112.48 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -104.08 139.48 39.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.746 0.308 . . . . 0.0 111.032 -177.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.634 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -88.11 175.97 7.49 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.408 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -54.47 -38.36 66.3 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.747 -171.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.634 HG22 ' OD1' ' A' ' 83' ' ' ASP . 8.3 t -73.69 -25.09 60.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.497 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.574 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 54.0 mtt -84.62 -39.61 18.46 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.51 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -65.38 -39.26 92.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.352 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.452 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.61 -25.37 53.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.422 -174.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.548 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 4.0 pt20 -83.1 -23.43 33.06 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.334 -0.547 . . . . 0.0 110.071 173.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.1 tt -82.97 -48.17 10.96 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.481 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -57.33 -36.19 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.883 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -65.77 -41.3 92.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.009 0.433 . . . . 0.0 110.568 -176.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.547 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.4 mp -62.46 -42.59 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.694 176.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 90' ' ' LEU . 34.2 mt -56.97 -48.13 82.16 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.152 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -67.0 -34.69 78.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.208 0.528 . . . . 0.0 110.233 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -48.81 5.57 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.705 -172.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 11.7 m -74.82 -31.45 61.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.734 -0.651 . . . . 0.0 112.669 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.586 ' CG ' HG11 ' A' ' 114' ' ' VAL . 37.5 mt-10 -57.36 -37.15 72.16 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.328 0.967 . . . . 0.0 109.833 166.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.79 -43.53 62.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.8 m -97.68 15.51 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.06 154.38 72.51 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.467 0.175 . . . . 0.0 110.573 177.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.42 ' HB2' ' OD1' ' A' ' 104' ' ' ASN . 13.8 Cg_exo -69.45 163.12 39.23 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.831 2.354 . . . . 0.0 110.939 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.44 40.72 0.29 Allowed 'Trans proline' 0 CA--C 1.534 0.515 0 C-N-CA 123.17 2.58 . . . . 0.0 113.379 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 102' ' ' PRO . 2.6 m-20 -83.07 93.69 7.65 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -81.57 94.48 6.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.984 0.421 . . . . 0.0 110.825 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.823 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 10.1 t70 -133.14 107.36 8.15 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -28.79 -58.74 0.13 Allowed 'General case' 0 N--CA 1.473 0.693 0 O-C-N 124.967 1.417 . . . . 0.0 114.59 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.22 -15.99 22.83 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.823 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 12.9 ttt -85.18 -25.49 27.36 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -167.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.17 -47.08 86.61 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.292 1.044 . . . . 0.0 110.741 -177.51 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.709 HG22 HD12 ' A' ' 112' ' ' ILE . 0.3 OUTLIER -53.94 -14.33 0.99 Allowed 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.29 174.308 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.714 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.6 mp -91.95 -41.68 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 1.0 OUTLIER -62.78 -32.43 73.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.735 176.644 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -80.39 -35.21 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 CA-C-O 121.211 0.529 . . . . 0.0 110.143 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.75 78.09 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.812 0.815 . . . . 0.0 111.557 174.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.715 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.57 -19.34 64.47 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.845 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.595 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 6.6 t -69.48 -30.32 68.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.105 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.537 ' HA ' HG12 ' A' ' 93' ' ' ILE . 62.9 t80 -70.99 -43.38 68.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.844 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 0.9 OUTLIER -69.35 -29.63 67.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.95 -1.1 . . . . 0.0 110.501 176.322 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.715 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -56.1 -47.88 77.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.413 0.625 . . . . 0.0 109.97 168.091 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.529 ' HG2' HD11 ' A' ' 93' ' ' ILE . 9.4 tp10 -57.09 -50.0 74.15 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.595 176.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -56.63 -31.26 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 120.629 0.252 . . . . 0.0 111.211 177.763 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.1 m80 -71.74 -32.09 67.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.66 ' HD3' ' O ' ' A' ' 124' ' ' LYS . 9.8 tmtt? -72.15 -27.9 62.9 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 92.8 mt -73.83 12.84 0.6 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.135 -0.938 . . . . 0.0 111.976 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -40.76 120.74 1.34 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.39 0.676 . . . . 0.0 112.115 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -80.05 28.85 0.28 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.395 -174.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.475 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 11.6 m -67.05 124.44 88.83 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.751 0.31 . . . . 0.0 110.969 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 17.5 Cg_exo -66.95 -56.96 0.21 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.769 2.312 . . . . 0.0 112.161 179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 51.4 t30 68.17 -72.19 0.1 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.835 0.709 . . . . 0.0 111.394 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 26.0 mmt -105.9 171.94 7.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.75 0.31 . . . . 0.0 110.476 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -103.62 -177.05 3.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.346 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.7 mp 52.99 67.42 1.0 Allowed 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.741 0.651 . . . . 0.0 110.775 -179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.7 p -80.55 95.93 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.48 0.657 . . . . 0.0 110.888 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 28.9 mm 61.45 83.53 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.028 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.39 87.47 0.35 Allowed Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.238 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -127.72 103.41 7.28 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.6 p -127.92 126.37 66.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.177 0.513 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.9 tp -89.51 -67.24 0.85 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.379 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . 68.98 130.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.044 0.84 . . . . 0.0 111.961 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLU . . . . . 0.569 ' HG3' HG12 ' A' ' 142' ' ' VAL . 12.2 pt-20 -80.34 -29.1 37.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.47 178.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.569 HG12 ' HG3' ' A' ' 141' ' ' GLU . 7.6 p . . . . . 0 C--O 1.249 1.028 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.8 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 120.585 0.231 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 130' ' ' ASN . 19.3 Cg_exo -66.89 -19.54 52.36 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.855 2.37 . . . . 0.0 112.176 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -46.48 -66.12 0.45 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.533 HD13 ' HB2' ' A' ' 82' ' ' ALA . 8.3 tp -81.3 -10.33 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.915 0.388 . . . . 0.0 111.56 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.35 -23.69 57.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.127 0.489 . . . . 0.0 110.037 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -91.12 114.92 27.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.273 172.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -62.35 138.79 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.964 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.18 -40.06 70.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.691 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 p -64.62 -34.85 79.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.144 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -71.58 -33.78 69.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.334 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.65 -53.87 24.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.549 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -46.67 -71.91 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.935 169.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.43 37.44 60.23 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.683 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -80.78 -49.72 10.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.152 0.501 . . . . 0.0 110.061 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -160.12 106.14 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.419 177.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 61.3 mtm -76.83 -21.15 55.47 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 175.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 32.0 t70 -58.8 -27.63 65.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.092 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.7 pt20 -84.07 -24.74 30.26 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.116 0.484 . . . . 0.0 109.884 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 63.5 m -73.45 -29.89 62.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 55.7 tptt -62.67 -53.42 54.72 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.721 177.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -69.69 -43.77 71.79 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.041 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -69.51 -41.18 76.4 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.293 -174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 7.1 mt -82.07 -16.58 49.59 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.613 -177.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.0 m 57.79 43.31 22.06 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.596 HD23 HD12 ' A' ' 47' ' ' LEU . 50.1 mt -57.65 129.71 81.25 Favored Pre-proline 0 N--CA 1.468 0.433 0 CA-C-N 114.669 -1.151 . . . . 0.0 110.262 -175.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 20.6 Cg_exo -65.88 155.83 67.34 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 121.95 1.767 . . . . 0.0 110.449 173.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.85 -34.82 70.13 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.069 0.462 . . . . 0.0 111.032 -176.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 m -70.18 -42.1 72.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.235 -176.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.566 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.4 t -72.62 -53.85 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.63 -173.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.684 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.9 p -59.64 -30.64 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.177 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.87 -52.46 56.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.75 175.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.25 -38.1 68.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -176.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.684 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 2.4 pp -61.43 -32.56 72.53 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.742 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -64.67 8.18 0.13 Allowed 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 174.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -67.05 111.99 4.15 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.272 1.396 . . . . 0.0 111.011 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.31 -4.36 58.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.05 0.452 . . . . 0.0 110.56 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -90.03 145.29 25.19 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -83.31 58.53 4.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.437 0.637 . . . . 0.0 110.636 -178.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 5.5 t70 -42.6 -40.68 2.78 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.524 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 40.9 m-20 78.62 25.41 0.54 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.783 0.72 . . . . 0.0 111.155 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.43 175.82 9.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 0.0 110.957 178.189 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.32 124.56 52.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttm -78.84 92.74 4.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.049 0.452 . . . . 0.0 110.484 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 -30.91 13.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.71 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.39 135.14 48.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 122.005 0.907 . . . . 0.0 110.827 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.851 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 1.5 mpt_? -73.69 -30.94 63.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.845 -1.525 . . . . 0.0 109.919 -170.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.596 HD12 HD23 ' A' ' 25' ' ' LEU . 4.1 mm? -73.64 -15.63 61.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.032 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.88 -59.22 2.49 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.941 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -38.82 -47.07 2.35 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 115.361 -0.836 . . . . 0.0 114.057 166.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -66.5 -41.07 89.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.452 1.126 . . . . 0.0 111.752 177.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.9 -18.06 65.2 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -177.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.2 mm -56.78 -37.34 52.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.921 0.391 . . . . 0.0 110.671 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.422 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 60.3 t30 -141.08 86.59 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 0.0 110.307 178.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.7 p -106.82 -46.85 3.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.473 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -68.2 -44.98 74.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.086 -174.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.26 -13.32 58.61 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.9 0.381 . . . . 0.0 110.246 -174.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.672 ' HA ' HG11 ' A' ' 61' ' ' VAL . 91.3 m -79.05 -34.56 43.68 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.297 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -75.93 -20.93 57.58 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.433 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.5 mt -65.42 -66.19 0.58 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.482 175.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -177.19 116.59 0.1 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.672 HG11 ' HA ' ' A' ' 57' ' ' THR . 7.0 p -173.31 32.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 121.313 0.578 . . . . 0.0 111.52 -174.123 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.629 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 23.4 m -109.55 115.88 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 121.161 -0.962 . . . . 0.0 111.992 -175.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -74.51 -54.5 3.04 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.766 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.643 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 18.7 Cg_endo -99.15 -141.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 123.134 2.556 . . . . 0.0 113.246 -172.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.503 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 17.9 m-20 -75.45 10.1 1.84 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.668 -175.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.38 -75.32 0.42 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.206 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.624 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.1 p30 -70.35 152.86 43.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.962 -0.619 . . . . 0.0 110.8 177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 68' ' ' LEU . 3.9 mm? 69.13 34.81 2.92 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.574 0.546 . . . . 0.0 112.106 173.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 6.4 p-80 -73.31 77.53 1.34 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.738 0.78 . . . . 0.0 110.514 174.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -86.41 -61.71 1.68 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.746 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.94 56.21 Favored Glycine 0 CA--C 1.51 -0.275 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.444 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -58.71 -28.53 65.9 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.181 . . . . 0.0 111.44 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.566 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.23 -37.15 66.49 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.697 -0.627 . . . . 0.0 110.885 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.9 mmmt -81.03 -31.42 34.57 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.111 178.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.73 -40.31 95.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.327 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.415 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 64.2 t80 -62.98 -32.35 73.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.89 -38.62 79.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.69 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.569 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 66.0 mtm -69.26 -27.69 65.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.315 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.947 ' HE3' ' HA ' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -91.42 -12.44 34.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.46 179.266 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -141.33 90.98 2.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 O-C-N 122.183 -0.323 . . . . 0.0 111.042 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 109.55 -62.49 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.432 -0.89 . . . . 0.0 113.524 173.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.569 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.38 124.36 34.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.634 0.254 . . . . 0.0 110.912 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 4.6 p-10 -83.75 171.34 13.27 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.551 174.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -48.54 72.61 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.393 -164.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.775 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.0 t -61.0 -36.74 80.28 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.054 -173.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 50.4 mtm -81.01 -38.96 26.64 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.409 0.623 . . . . 0.0 109.5 -173.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.55 -39.64 84.65 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.165 173.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.49 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.32 -25.92 61.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.368 -177.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.775 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.1 mm-40 -77.99 -25.58 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 tp -88.13 -46.36 9.35 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.494 -176.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.4 m -56.92 -36.61 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.108 -173.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -65.73 -42.37 91.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.901 0.381 . . . . 0.0 110.579 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.576 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.6 mp -61.85 -38.88 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.041 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 47.1 mt -59.91 -45.79 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.209 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -68.51 -34.45 75.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.29 -49.68 5.13 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.47 -0.872 . . . . 0.0 112.244 -173.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 7.7 m -73.33 -31.23 63.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.563 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.765 ' HG3' HG11 ' A' ' 114' ' ' VAL . 18.8 mt-10 -65.29 -34.43 78.32 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.401 1.001 . . . . 0.0 110.271 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -64.81 -44.03 91.22 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.171 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.6 m -101.49 9.11 41.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -174.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -67.66 150.34 97.87 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.5 159.75 15.72 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 0.0 111.358 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.48 23.88 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.535 2.157 . . . . 0.0 113.078 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -94.71 91.92 6.75 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.48 95.98 7.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.558 0.694 . . . . 0.0 110.427 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.75 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.4 t70 -101.26 133.69 45.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.791 177.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -29.39 -72.32 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 O-C-N 125.327 1.642 . . . . 0.0 112.947 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.0 t -96.41 -21.79 17.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.851 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 59.1 ttp -77.39 -15.75 59.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.883 -0.51 . . . . 0.0 112.237 -168.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.428 ' CG ' ' H ' ' A' ' 111' ' ' THR . 12.1 ptmm? -56.27 -51.76 66.99 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 122.431 1.11 . . . . 0.0 109.355 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.428 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -60.18 -13.0 10.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.446 173.011 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.941 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -89.02 -40.58 13.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.29 -37.26 84.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.652 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.765 HG11 ' HG3' ' A' ' 98' ' ' GLU . 12.1 m -77.61 -35.67 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.885 178.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.27 76.55 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.17 0.51 . . . . 0.0 111.204 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.539 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 21.6 ptt? -69.79 -17.91 63.44 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.478 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.968 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 39.5 t -69.46 -32.78 71.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 122.143 0.973 . . . . 0.0 109.022 176.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -74.11 -38.11 63.93 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.93 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.589 ' C ' ' HD2' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -67.66 -26.37 66.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 118.364 -1.334 . . . . 0.0 111.629 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.968 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -64.72 -56.36 14.19 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.539 -1.265 . . . . 0.0 109.354 172.05 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.0 -41.65 88.17 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.944 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -35.18 56.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.305 0.502 . . . . 0.0 110.697 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -72.06 -30.52 65.23 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 176.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -72.5 -33.71 67.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.121 0.486 . . . . 0.0 110.146 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.56 -35.49 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.412 171.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 69.29 -86.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.464 0.706 . . . . 0.0 112.391 176.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -76.5 124.25 27.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.201 0.524 . . . . 0.0 112.171 -173.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.2 m -124.12 155.22 68.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.526 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 130' ' ' ASN . 16.9 Cg_exo -68.18 93.01 0.4 Allowed 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.702 2.268 . . . . 0.0 113.069 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASN . . . . . 0.47 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . 2.8 p-10 176.23 165.69 0.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.055 171.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.6 mmt -129.58 137.11 50.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.703 0.287 . . . . 0.0 110.658 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -87.34 95.45 10.0 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.971 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.908 ' H ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -99.67 8.74 44.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.402 -177.668 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 30.4 t -94.58 86.68 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.043 0.449 . . . . 0.0 110.305 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.84 111.85 35.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -165.25 -57.91 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.885 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 53.24 84.21 0.06 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.445 0.64 . . . . 0.0 110.526 -178.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.98 115.55 2.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.942 -175.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.2 tp -113.94 105.75 13.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.188 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -107.99 -174.62 2.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.628 -174.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 66.47 28.83 9.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.926 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.25 1.09 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.202 176.581 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.907 0.384 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.435 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 82.1 Cg_endo -90.2 -0.67 5.47 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.924 2.416 . . . . 0.0 112.645 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -50.17 -70.61 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.903 0.752 . . . . 0.0 112.376 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.456 HD12 ' HB2' ' A' ' 82' ' ' ALA . 14.5 tt -87.2 -10.75 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.61 177.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.435 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 51.1 ttp -62.65 -40.76 98.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.469 0.652 . . . . 0.0 109.53 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -92.18 100.59 13.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.568 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 10' ' ' ASN . 57.2 m-80 -61.54 124.77 21.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.309 -172.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.12 -30.61 71.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.143 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 3.4 p -69.31 -35.34 75.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.577 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -72.4 -26.59 61.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.278 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.55 -40.01 84.98 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.507 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 33.0 m-85 -55.02 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.341 168.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.64 36.08 17.73 Favored Glycine 0 C--N 1.346 1.085 0 C-N-CA 121.108 -0.568 . . . . 0.0 113.747 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 2.2 tmmm? -65.88 -39.14 90.4 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.026 0.441 . . . . 0.0 110.58 -177.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.01 96.91 2.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.131 0.491 . . . . 0.0 111.498 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -80.14 -32.71 38.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -56.59 -40.49 75.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.307 -1.315 . . . . 0.0 111.693 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -88.12 -24.78 23.29 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.42 -169.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.2 t -73.37 -36.07 66.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 119.949 -0.7 . . . . 0.0 109.138 173.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 1.095 ' HA ' HD13 ' A' ' 25' ' ' LEU . 10.6 tptt -63.44 -39.29 94.09 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.643 0.735 . . . . 0.0 109.877 176.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -69.19 -40.92 77.76 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.651 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -71.46 -44.47 64.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.769 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 10.6 mt -86.35 -4.8 59.24 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.463 -175.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.3 t 63.3 34.26 13.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.509 176.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.095 HD13 ' HA ' ' A' ' 20' ' ' LYS . 6.4 mp -50.42 119.24 10.66 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.931 -176.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.0 Cg_exo -73.75 162.89 38.55 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.979 2.453 . . . . 0.0 111.655 174.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.624 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.4 p-10 -62.81 -29.67 70.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -174.021 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 t -68.18 -37.61 81.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.339 0.59 . . . . 0.0 110.03 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.926 HG21 HD23 ' A' ' 47' ' ' LEU . 41.5 t -75.45 -49.96 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.706 -177.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.624 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.6 m -55.91 -35.12 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.672 0.272 . . . . 0.0 110.749 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.57 69.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 0.0 111.632 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -68.43 -38.33 81.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.9 0.857 . . . . 0.0 109.17 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 3.1 tm? -55.76 -55.67 29.61 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.996 175.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -67.9 12.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -56.19 110.96 0.84 Allowed 'General case' 0 C--N 1.35 0.6 0 CA-C-N 120.051 1.296 . . . . 0.0 110.547 -179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -78.71 -27.86 45.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.679 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -88.3 157.77 18.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 -174.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.505 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 7.1 mptt -82.83 61.24 5.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.764 -175.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.588 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 1.0 OUTLIER -43.79 -48.21 8.12 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.628 176.108 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 68.19 19.68 9.06 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 118.258 0.481 . . . . 0.0 111.016 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.588 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -78.42 179.12 7.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.005 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 t -89.66 130.61 38.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.318 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 42.3 ttm -65.29 104.47 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.089 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.0 p -87.25 -40.62 14.36 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -173.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.514 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 6.2 t70 -90.64 117.48 29.33 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-O 122.284 1.04 . . . . 0.0 110.718 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.58 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.02 -38.45 62.38 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 113.161 -1.836 . . . . 0.0 112.242 175.551 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.926 HD23 HG21 ' A' ' 29' ' ' VAL . 46.5 tp -68.82 -18.18 64.13 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.939 0.399 . . . . 0.0 111.05 -174.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.7 -55.99 5.01 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.72 -45.37 1.48 Allowed Glycine 0 CA--C 1.533 1.159 0 CA-C-N 114.727 -1.124 . . . . 0.0 114.41 165.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 57.5 m -65.54 -43.41 90.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 118.09 0.945 . . . . 0.0 110.319 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -68.39 -25.45 65.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.776 -176.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.4 mt -77.24 -26.66 15.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 110.33 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.76 44.36 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 -45.18 2.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.5 -170.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 3.2 mm? -46.46 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.19 -15.49 53.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.811 0.338 . . . . 0.0 110.899 -172.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.421 HG23 HG11 ' A' ' 61' ' ' VAL . 1.5 m -78.62 -32.06 47.26 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.746 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.612 ' HB3' ' NZ ' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.52 -23.43 34.61 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.779 174.289 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 10.6 mt -63.38 -59.95 4.01 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 121.179 -0.209 . . . . 0.0 111.249 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -174.01 122.53 0.31 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -176.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HB3' ' A' ' 72' ' ' ASN . 9.8 p -177.11 33.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 121.59 0.71 . . . . 0.0 111.142 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.651 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 35.5 m -98.3 114.07 34.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 O-C-N 121.25 -0.907 . . . . 0.0 110.579 -176.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -56.75 4.1 Favored Pre-proline 0 CA--C 1.53 0.198 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.237 -176.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.585 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 4.4 Cg_endo -91.81 -144.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.815 2.343 . . . . 0.0 112.715 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -74.64 10.5 1.34 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.371 -176.393 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.01 -75.55 0.31 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.572 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.585 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p30 -75.06 168.61 19.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.051 -0.575 . . . . 0.0 111.075 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 70.12 28.62 3.99 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 123.76 0.663 . . . . 0.0 111.952 173.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 13.1 p-80 -76.83 65.9 2.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.402 0.62 . . . . 0.0 110.832 172.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -88.9 -49.75 6.61 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.138 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.11 -51.86 54.84 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.502 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.434 ' HB3' HG22 ' A' ' 61' ' ' VAL . 1.6 t-20 -59.24 -35.65 74.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.72 -0.24 . . . . 0.0 111.512 -176.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.86 -37.07 70.28 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.1 0.476 . . . . 0.0 111.068 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.606 ' O ' ' HG3' ' A' ' 78' ' ' MET . 5.2 mmmp? -80.64 -36.14 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.828 -178.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.489 ' HA ' ' HE2' ' A' ' 78' ' ' MET . 26.0 t70 -65.58 -41.04 93.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -60.63 -37.8 82.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.088 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.79 71.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.298 178.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.1 mtm -74.36 -34.96 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.797 0.332 . . . . 0.0 111.803 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -93.88 -8.42 40.34 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.93 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -141.89 88.53 2.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.72 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.17 -74.79 0.43 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.424 -0.893 . . . . 0.0 112.621 177.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.532 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -107.66 141.13 39.64 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 165.63 23.77 Favored 'General case' 0 CA--C 1.489 -1.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 11.2 pt-20 -67.49 -21.39 65.51 Favored 'General case' 0 N--CA 1.409 -2.484 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.628 -164.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.71 -28.2 63.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.643 -179.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 38.8 mtt -83.74 -39.76 19.69 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.578 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.59 -37.74 87.51 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.718 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.71 -27.01 50.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.8 -174.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -79.96 -24.19 41.15 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.209 172.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.492 ' O ' HG13 ' A' ' 94' ' ' ILE . 25.6 tp -81.41 -46.15 15.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.13 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 87' ' ' ALA . 17.7 m -57.57 -33.32 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.959 -175.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.77 -45.16 87.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.326 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.66 -40.0 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 91' ' ' VAL . 74.2 mt -54.43 -50.05 60.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.275 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -71.76 -33.41 68.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.645 -174.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.1 -49.55 5.53 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.684 -174.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 114' ' ' VAL . 0.1 OUTLIER -72.63 -28.59 62.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.796 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.51 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.9 tt0 -62.33 -38.62 90.15 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.672 0.273 . . . . 0.0 111.405 170.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -67.43 -33.69 75.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.893 0.378 . . . . 0.0 110.481 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.5 m -96.38 8.76 43.2 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.279 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.61 155.59 87.22 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.705 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 92.2 Cg_exo -45.08 140.59 7.25 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.159 2.573 . . . . 0.0 112.425 176.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.8 Cg_exo -69.59 24.81 0.17 Allowed 'Trans proline' 0 N--CA 1.476 0.469 0 C-N-CA 123.695 2.93 . . . . 0.0 113.703 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' A' ' 102' ' ' PRO . 89.3 m-20 -109.04 93.95 4.78 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -76.46 95.13 3.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.654 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.7 t70 -121.2 124.42 44.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.275 172.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.581 ' HD2' ' H ' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -33.81 -51.31 0.39 Allowed 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -178.346 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.581 ' H ' ' HD2' ' A' ' 107' ' ' LYS . 91.4 m -92.4 -30.71 15.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.654 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 62.6 mmm -61.67 -46.08 91.27 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 122.1 0.953 . . . . 0.0 110.162 -176.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.68 ' O ' HG13 ' A' ' 114' ' ' VAL . 15.8 ptmt -66.09 -50.56 63.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.485 -178.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -58.66 -15.33 11.28 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.27 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.5 mp -89.16 -39.67 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -38.97 87.44 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.188 174.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 110' ' ' LYS . 2.8 m -80.13 -39.33 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 121.497 0.665 . . . . 0.0 110.11 -173.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.78 -41.39 99.23 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.03 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.659 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -67.33 -24.52 65.74 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.49 -177.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 86.6 m -66.63 -30.74 71.08 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.183 0.516 . . . . 0.0 109.943 174.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -70.07 -40.64 74.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.246 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.5 OUTLIER -68.49 -20.4 64.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.898 177.366 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.659 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.84 -49.26 71.29 Favored 'General case' 0 C--N 1.342 0.28 0 O-C-N 121.815 -0.553 . . . . 0.0 109.559 168.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 10.1 mm-40 -58.7 -50.84 72.38 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.165 176.139 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.512 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -54.12 -36.12 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 117.629 0.195 . . . . 0.0 111.24 178.725 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -70.55 -32.65 70.16 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -68.87 -35.6 77.1 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 110.079 175.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 72.1 mt -68.06 -36.35 79.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.6 174.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.22 -54.55 29.68 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.981 0.512 . . . . 0.0 112.111 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -57.78 107.17 0.43 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.724 -0.217 . . . . 0.0 110.796 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 15.3 m 38.53 83.1 0.21 Allowed Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 124.359 1.037 . . . . 0.0 113.262 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -80.99 156.62 20.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.642 2.228 . . . . 0.0 111.918 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -63.49 130.96 46.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.159 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 22.3 ttt -77.61 108.47 10.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.025 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -150.06 106.99 3.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.84 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 133' ' ' LEU . 3.7 mm? -94.62 90.21 6.05 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.331 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.3 p -94.05 93.36 3.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.777 0.799 . . . . 0.0 110.82 178.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.17 104.13 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.785 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -94.02 58.47 2.09 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.426 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -131.84 134.22 45.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.945 0.402 . . . . 0.0 111.225 -174.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -156.2 133.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.293 174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.7 tp -106.04 98.83 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.82 0.343 . . . . 0.0 110.695 -175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.14 105.64 4.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.701 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -123.24 118.92 28.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.544 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 44.4 t . . . . . 0 C--O 1.249 1.06 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.962 -175.33 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.621 ' H2 ' ' HD2' ' A' ' 2' ' ' PRO . 18.3 m . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.863 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 19.0 Cg_endo -58.21 -14.37 19.4 Favored 'Trans proline' 0 C--N 1.363 1.319 0 C-N-CA 122.783 2.322 . . . . 0.0 113.95 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.3 mp0 -45.03 -67.56 0.27 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.389 0.43 . . . . 0.0 111.281 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.718 HD13 ' HB2' ' A' ' 82' ' ' ALA . 9.3 tp -87.68 -11.04 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.84 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.863 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.9 mtp -72.9 -21.44 60.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.957 0.408 . . . . 0.0 110.947 -178.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -86.7 81.14 8.32 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 171.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.628 HD21 HG13 ' A' ' 52' ' ' ILE . 3.8 m-20 -61.75 130.39 45.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.886 -176.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.3 -33.78 69.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.51 -178.353 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.4 t -62.03 -39.41 92.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 109.956 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -76.13 -31.16 58.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.787 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -67.92 -49.55 61.23 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -48.26 -74.2 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.942 170.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 52.66 35.59 46.32 Favored Glycine 0 C--N 1.344 0.981 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.477 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -73.95 -37.51 64.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 121.053 0.454 . . . . 0.0 110.319 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.476 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.52 104.36 4.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.525 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 53.2 ttm -81.16 -32.29 33.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.241 0.544 . . . . 0.0 109.569 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.8 -33.0 68.1 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.7 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -88.1 -25.01 23.23 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.076 -0.65 . . . . 0.0 111.362 -173.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.45 -34.95 70.71 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -63.68 -48.1 78.55 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.374 0.607 . . . . 0.0 110.205 176.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.4 -47.6 60.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.465 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 2.8 tp10 -69.51 -35.14 75.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.451 0.167 . . . . 0.0 111.349 -173.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.662 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 3.9 mm? -77.31 -22.19 52.32 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 120.939 0.4 . . . . 0.0 110.423 176.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.1 m 58.55 41.52 22.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.53 -169.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CB ' ' A' ' 23' ' ' LEU . 55.9 mt -65.68 139.43 97.03 Favored Pre-proline 0 CA--C 1.516 -0.342 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.861 -172.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.577 ' HG2' HG23 ' A' ' 29' ' ' VAL . 75.1 Cg_endo -82.24 163.64 17.37 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.734 2.289 . . . . 0.0 110.259 170.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.82 -33.44 75.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.757 0.313 . . . . 0.0 111.17 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.2 p -67.89 -47.36 69.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 -178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.577 HG23 ' HG2' ' A' ' 26' ' ' PRO . 65.1 t -73.43 -46.94 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.377 -173.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.51 -32.2 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 118.743 0.701 . . . . 0.0 110.634 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.44 -52.01 37.45 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.806 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -66.84 -33.92 76.67 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.6 tp -49.43 -53.98 19.95 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.931 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -65.58 11.89 0.06 Allowed 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.75 98.91 0.21 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.813 1.642 . . . . 0.0 109.789 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -73.5 -20.83 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.129 -174.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -76.76 147.41 37.31 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -76.08 67.52 2.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.863 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.653 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 3.1 t70 -43.44 -52.23 6.14 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.601 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.776 ' HB3' ' H ' ' A' ' 131' ' ' MET . 26.9 t70 73.19 20.41 3.34 Favored 'General case' 0 C--N 1.355 0.842 0 CA-C-O 122.243 1.021 . . . . 0.0 109.583 -177.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.653 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -85.17 177.97 7.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.359 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.8 t -89.84 126.69 42.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.942 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.8 ttm -71.66 103.43 3.04 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.28 -40.95 17.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.18 -172.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.485 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.0 t70 -89.06 116.63 27.47 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.771 0.796 . . . . 0.0 110.316 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.734 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -54.12 -37.13 64.01 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.901 -1.499 . . . . 0.0 112.257 176.239 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.576 HD21 ' HD3' ' A' ' 26' ' ' PRO . 27.9 tp -66.54 -15.25 63.26 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.286 0.565 . . . . 0.0 110.813 -174.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.31 -51.6 8.7 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.807 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.34 -45.76 3.34 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.004 -0.998 . . . . 0.0 114.366 165.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.509 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 4.0 m -62.0 -46.35 89.61 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.621 1.21 . . . . 0.0 110.061 177.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB2' ' HG ' ' A' ' 23' ' ' LEU . . . -80.28 1.74 27.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.006 -175.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 7' ' ' ASN . 1.9 tp -62.54 -26.91 41.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 173.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 62.9 t30 -147.32 86.07 1.61 Allowed 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.394 174.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.435 ' HB3' HD21 ' A' ' 23' ' ' LEU . 16.3 p -101.75 -45.28 5.28 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.524 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.523 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 mt -70.24 -44.48 68.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 0.0 111.49 -173.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.414 ' HB3' ' OD1' ' A' ' 53' ' ' ASN . . . -80.67 -13.2 59.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 -175.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.595 ' HA ' HG11 ' A' ' 61' ' ' VAL . 98.9 m -83.09 -36.75 24.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.164 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.439 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 25.0 mtpp -71.52 -21.43 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.56 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 53.4 mt -65.35 -65.67 0.64 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.373 175.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -175.45 113.11 0.13 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.314 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.595 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.0 p -175.38 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.594 0.712 . . . . 0.0 111.408 -177.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.705 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.4 m -103.66 120.9 54.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 120.888 -1.132 . . . . 0.0 111.088 -177.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.33 -56.18 5.51 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.74 177.018 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.0 Cg_endo -97.06 -139.21 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.228 2.619 . . . . 0.0 112.761 -171.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.421 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 65.0 m-20 -75.67 11.94 1.19 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.404 -173.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.32 -71.6 0.5 Allowed Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -174.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.619 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p-10 -77.51 156.03 31.26 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.824 -0.688 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.75 41.39 1.21 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.382 0.611 . . . . 0.0 111.833 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.705 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 5.5 p80 -78.25 80.11 4.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.15 177.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -86.88 -62.59 1.47 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.055 -178.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.07 -54.75 35.43 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.685 -177.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -56.08 -34.66 66.18 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.626 0.251 . . . . 0.0 111.347 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.531 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -66.91 -35.78 80.78 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.246 0.545 . . . . 0.0 111.006 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.57 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.5 mmmt -79.79 -40.01 29.58 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.316 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.59 -39.73 94.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.812 0.339 . . . . 0.0 110.276 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -57.88 -40.85 81.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.541 175.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.04 78.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.716 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.57 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 56.2 mtt -69.93 -39.45 76.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.001 0.429 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -89.08 -9.34 51.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.96 0.409 . . . . 0.0 110.556 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -143.69 91.24 2.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.411 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 118.3 -76.43 0.29 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.565 175.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.718 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.04 137.02 33.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.653 0.264 . . . . 0.0 110.697 -176.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -79.2 154.96 28.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 121.369 0.604 . . . . 0.0 109.762 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -63.39 -43.83 96.46 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.985 -167.162 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.572 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 2.8 m -51.57 -45.68 63.19 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.863 174.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 2.7 ptm -76.32 -39.33 54.35 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.413 0.625 . . . . 0.0 109.419 -177.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -61.03 -36.38 79.38 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.02 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.734 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.7 mp0 -70.8 -25.27 62.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.976 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.4 mm-40 -78.08 -24.46 47.63 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.528 ' O ' HG13 ' A' ' 94' ' ' ILE . 23.4 tp -87.23 -46.16 9.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.683 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' A' ' 88' ' ' GLN . 5.2 m -60.89 -28.51 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -44.17 93.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.65 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.8 mp -67.52 -41.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.118 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 90' ' ' LEU . 54.5 mt -57.5 -46.95 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.247 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -70.14 -33.85 72.32 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.418 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -54.93 3.23 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.151 -1.023 . . . . 0.0 112.263 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.0 m -72.97 -31.39 64.5 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.434 ' HB2' HG11 ' A' ' 114' ' ' VAL . 42.3 tt0 -68.13 -36.39 79.63 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.456 1.025 . . . . 0.0 110.789 171.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' A' ' 99' ' ' LYS . 23.9 ttpp -64.27 -43.21 95.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.918 0.39 . . . . 0.0 110.858 177.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 m -104.1 25.53 9.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.25 155.42 92.36 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.297 178.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 50.8 Cg_exo -53.7 155.23 14.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.594 2.196 . . . . 0.0 111.699 176.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 15.1 Cg_exo -70.22 24.64 0.19 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.232 2.621 . . . . 0.0 113.191 -177.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 102' ' ' PRO . 85.2 m-20 -105.4 93.37 4.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -79.5 95.43 5.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.816 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.3 t0 -105.56 120.39 41.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.077 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -29.03 -73.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 O-C-N 125.312 1.633 . . . . 0.0 113.689 -176.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.488 ' O ' HG22 ' A' ' 111' ' ' THR . 18.0 t -97.68 -7.26 31.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.816 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.4 ttt -82.56 -28.2 31.1 Favored 'General case' 0 C--O 1.251 1.134 0 O-C-N 121.417 -0.802 . . . . 0.0 113.005 -168.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.662 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.2 OUTLIER -56.94 -45.15 82.96 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.929 0.871 . . . . 0.0 110.736 -173.125 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.662 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.6 t -58.87 -10.59 2.53 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 0.0 113.126 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.807 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -91.5 -39.56 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -58.23 -38.87 77.7 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.222 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.654 HG22 ' HA ' ' A' ' 111' ' ' THR . 6.3 m -84.88 -31.38 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 CA-C-O 121.416 0.627 . . . . 0.0 110.041 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.12 -46.35 90.93 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.246 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.557 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.3 ptt? -67.95 -20.45 65.06 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.111 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.917 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 21.4 t -68.69 -30.26 68.89 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.482 0.658 . . . . 0.0 109.263 174.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.65 ' HA ' HG12 ' A' ' 93' ' ' ILE . 71.6 t80 -77.16 -49.37 15.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.298 -178.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.516 ' C ' ' HE3' ' A' ' 119' ' ' LYS 0.254 0.0 OUTLIER -70.96 -16.55 62.66 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.072 177.757 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.917 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -62.26 -54.38 41.61 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.303 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -58.72 -48.96 79.36 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.343 174.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -33.99 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 122.002 -0.436 . . . . 0.0 111.326 178.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -71.98 -31.61 66.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.96 -0.463 . . . . 0.0 111.767 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -66.6 -37.44 84.9 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.924 0.392 . . . . 0.0 110.527 175.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.94 -36.47 82.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.848 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.9 t30 72.46 120.09 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.337 1.065 . . . . 0.0 112.082 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 19.8 p-90 -135.19 22.4 3.48 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.61 177.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 58.4 t 71.28 90.23 0.08 OUTLIER Pre-proline 0 C--O 1.234 0.249 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.821 -170.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.54 162.08 43.76 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 123.171 2.581 . . . . 0.0 111.86 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -117.44 -74.24 0.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.857 -176.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' MET . . . . . 0.776 ' H ' ' HB3' ' A' ' 40' ' ' ASP . 23.6 ptt? 35.55 75.33 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.273 0.983 . . . . 0.0 112.157 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -80.52 105.68 11.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.739 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.5 tp -74.45 104.81 5.31 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.358 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 34.6 m -84.35 2.1 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.032 178.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm 73.42 124.6 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.8 -149.91 3.34 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.684 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -155.47 129.74 8.9 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.369 -0.489 . . . . 0.0 111.143 179.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 95.4 t -87.39 135.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.461 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.724 HD23 ' H ' ' A' ' 139' ' ' LEU . 2.1 pt? -111.88 113.44 25.77 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 174.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -121.12 158.1 28.66 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.787 -175.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -141.41 165.4 27.62 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.707 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.245 0.846 0 CA-C-O 119.014 -0.517 . . . . 0.0 110.601 178.956 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.444 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 26.1 p . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 110.456 -0.201 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.649 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 13.0 Cg_endo -57.96 -21.48 49.93 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.858 2.372 . . . . 0.0 112.8 179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 1' ' ' SER . 2.3 mp0 -54.04 -69.7 0.12 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.127 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 tp -73.91 -13.43 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 110.926 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.649 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.3 ttt -72.39 -29.97 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.059 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -81.52 96.84 7.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.44 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.461 HD21 HG23 ' A' ' 52' ' ' ILE . 25.8 t-20 -66.55 128.46 36.3 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD11 ' O ' ' A' ' 80' ' ' HIS . 22.2 mt -54.94 -45.64 74.88 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -176.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -66.12 -35.51 80.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.453 0.168 . . . . 0.0 110.914 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -70.45 -36.68 74.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.136 0.493 . . . . 0.0 110.482 177.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -67.3 -55.36 14.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.907 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 31.2 m-85 -50.41 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.49 -0.777 . . . . 0.0 113.036 173.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.06 35.69 54.78 Favored Glycine 0 C--N 1.342 0.911 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.188 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 9.0 tmtt? -85.44 -36.81 20.39 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.985 0.422 . . . . 0.0 110.155 -176.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.55 88.38 2.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.28 0.562 . . . . 0.0 110.873 -176.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.6 mtm -82.53 -45.62 14.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.051 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -60.24 -44.61 95.1 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.119 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 3.7 mm100 -87.23 -21.05 26.08 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.279 -171.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -75.72 -31.9 59.83 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 170.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 25' ' ' LEU . 27.5 tptp -57.8 -55.39 35.51 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.49 178.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -73.85 -39.57 63.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.09 -177.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 19.1 tt0 -70.35 -32.73 70.56 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -172.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.485 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -83.8 -1.16 53.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.019 0.438 . . . . 0.0 110.08 178.892 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t 63.81 29.06 14.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.901 -177.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.669 HD21 ' HB2' ' A' ' 51' ' ' ALA . 21.3 mt -70.62 128.34 91.11 Favored Pre-proline 0 N--CA 1.45 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.521 -172.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 57.6 Cg_endo -79.76 151.92 22.11 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 121.798 1.666 . . . . 0.0 108.847 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -31.83 66.31 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.871 -176.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 p -65.06 -52.81 53.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.653 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.571 HG23 ' HG2' ' A' ' 26' ' ' PRO . 90.0 t -69.5 -50.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -175.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.556 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.6 p -61.18 -32.75 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.827 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.05 -46.67 50.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.953 0.406 . . . . 0.0 111.12 177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.28 -38.25 88.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.182 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.578 HD13 ' HB1' ' A' ' 48' ' ' ALA . 23.4 tp -55.7 -56.86 15.47 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.855 171.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -68.59 11.64 0.17 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -52.12 125.44 15.68 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 120.24 1.382 . . . . 0.0 110.223 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -70.21 -33.68 71.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.631 -175.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -90.5 142.91 27.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.561 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -75.8 78.21 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.42 0.629 . . . . 0.0 110.918 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -42.83 -46.72 5.36 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.759 173.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 70.42 32.25 2.78 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.835 0.826 . . . . 0.0 110.112 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.28 175.69 9.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.836 175.579 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.0 t -90.95 127.3 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 169.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.9 ttm -69.31 94.38 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.181 0.515 . . . . 0.0 109.797 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 p -85.01 -36.26 21.4 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.141 -174.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.542 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.8 t70 -87.04 117.0 25.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.754 0.788 . . . . 0.0 110.597 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.63 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.39 -37.5 62.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.354 175.612 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.664 HD21 ' HD3' ' A' ' 26' ' ' PRO . 33.4 tp -68.92 -14.87 63.3 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.234 0.54 . . . . 0.0 111.013 -172.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.578 ' HB1' HD13 ' A' ' 33' ' ' LEU . . . -76.74 -54.83 6.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.94 -47.17 1.85 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.505 166.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 5.9 m -63.16 -45.02 93.83 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.242 1.021 . . . . 0.0 110.645 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.669 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -72.34 -11.41 60.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.276 -176.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.461 HG23 HD21 ' A' ' 7' ' ' ASN . 67.6 mt -58.67 -39.03 74.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 109.846 173.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.58 84.81 2.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.597 0.713 . . . . 0.0 110.425 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -116.32 -48.26 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.751 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.32 -48.29 23.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 111.484 -172.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HB1' ' HZ ' ' A' ' 76' ' ' PHE . . . -81.01 -15.61 55.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.366 0.603 . . . . 0.0 109.958 -174.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.783 HG23 HG11 ' A' ' 61' ' ' VAL . 55.4 m -80.71 -35.89 32.91 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.267 174.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -71.8 -22.46 61.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -63.67 -64.04 1.01 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.059 175.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -175.24 119.86 0.19 Allowed 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.783 HG11 HG23 ' A' ' 57' ' ' THR . 10.4 p -171.11 32.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.645 0.736 . . . . 0.0 111.096 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.627 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 1.3 m -108.12 122.08 62.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.037 -1.04 . . . . 0.0 111.2 -175.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -53.58 2.77 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.013 177.116 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.649 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 22.7 Cg_endo -99.72 -139.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.08 2.52 . . . . 0.0 113.326 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.5 t70 -72.9 10.67 0.83 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.477 -173.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.75 -67.84 0.55 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.203 -0.998 . . . . 0.0 111.523 -173.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.649 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.0 p30 -82.37 154.93 24.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.95 -0.625 . . . . 0.0 111.243 -178.247 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.4 mm? 69.32 38.57 1.82 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.228 173.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.627 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 14.3 p80 -75.78 81.06 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.371 0.605 . . . . 0.0 111.233 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -86.41 -61.67 1.69 Allowed 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.744 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.97 -56.37 25.11 Favored Glycine 0 CA--C 1.508 -0.378 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.79 -175.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -55.49 -29.63 59.14 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 123.712 0.301 . . . . 0.0 111.44 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.565 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.74 -36.51 65.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.36 0.6 . . . . 0.0 111.235 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.588 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.2 mmmt -79.18 -39.8 32.46 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.439 ' O ' ' HD2' ' A' ' 79' ' ' LYS . 21.4 t70 -60.7 -41.02 94.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.976 174.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HZ ' ' HB1' ' A' ' 56' ' ' ALA . 54.3 t80 -56.44 -42.78 78.68 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.084 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.37 -25.19 63.15 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.483 -0.487 . . . . 0.0 111.264 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.588 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 48.4 mtt -68.39 -39.48 81.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.357 178.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HD2' ' O ' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -93.41 -7.84 43.46 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.466 178.001 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.499 ' O ' HD11 ' A' ' 8' ' ' LEU . 46.0 m80 -134.71 89.21 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.711 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 123.32 -68.65 0.47 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.329 -0.939 . . . . 0.0 112.9 171.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.1 150.48 20.79 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.032 0.444 . . . . 0.0 111.478 -175.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.63 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 5.5 m-20 -76.66 151.22 36.24 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.11 -32.69 69.34 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.151 -168.06 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.26 -28.63 65.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.848 174.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 20.1 mtm -88.24 -41.59 12.84 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.592 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.82 -39.24 80.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.442 171.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.516 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -74.85 -27.16 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 122.642 0.377 . . . . 0.0 111.776 -175.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 4.0 pt20 -80.99 -22.81 39.18 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.589 172.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -83.42 -42.19 17.25 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.911 -179.149 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.6 m -57.59 -32.47 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -45.12 95.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.158 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.622 HG23 ' SG ' ' A' ' 117' ' ' CYS . 3.3 mm -65.84 -44.16 92.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.53 174.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.5 mt -52.72 -47.8 50.04 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.771 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -70.19 -34.75 73.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.424 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.52 -52.36 3.98 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.59 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.6 m -72.29 -32.19 66.39 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.924 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.543 ' HB2' HG11 ' A' ' 114' ' ' VAL . 34.0 tt0 -67.86 -38.41 83.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.959 0.8 . . . . 0.0 110.411 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.62 -43.54 89.24 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.941 0.4 . . . . 0.0 110.49 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -96.01 16.99 16.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.046 -176.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.39 151.42 91.93 Favored Pre-proline 0 C--N 1.325 -0.48 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.445 ' C ' ' H ' ' A' ' 104' ' ' ASN . 52.5 Cg_exo -53.51 156.64 10.85 Favored 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 122.779 2.319 . . . . 0.0 112.156 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.07 24.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.062 2.508 . . . . 0.0 113.265 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 102' ' ' PRO . 67.5 m-20 -90.17 93.91 9.55 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -80.94 96.55 7.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.05 -177.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.916 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 11.9 t70 -122.32 105.87 10.58 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -29.26 -58.49 0.15 Allowed 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.954 1.409 . . . . 0.0 114.116 -177.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.8 t -93.98 -12.69 28.16 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.89 -0.506 . . . . 0.0 112.246 -173.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.916 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.3 ttt -85.7 -27.62 25.19 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.777 0.799 . . . . 0.0 111.617 -169.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.14 -39.15 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.257 -177.433 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -16.82 9.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.685 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.588 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.8 mp -87.73 -36.0 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.86 -36.2 74.22 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.781 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.543 HG11 ' HB2' ' A' ' 98' ' ' GLU . 8.5 m -80.21 -38.35 18.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 O-C-N 121.919 -0.488 . . . . 0.0 110.758 177.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.89 -46.92 88.71 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.864 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.797 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.18 -21.02 60.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.775 178.219 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.622 ' SG ' HG23 ' A' ' 93' ' ' ILE . 11.2 t -66.92 -28.68 68.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 0.0 109.804 171.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -81.04 -48.16 12.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.916 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.797 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.1 -29.25 66.17 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 118.473 -1.291 . . . . 0.0 110.404 -179.873 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 116' ' ' MET . 11.0 ttmt -55.4 -54.85 38.63 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.24 170.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 19.9 mm-40 -57.76 -51.59 68.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.609 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.8 tt -59.33 -33.16 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 118.034 0.379 . . . . 0.0 111.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -71.96 -30.72 65.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.314 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -74.13 -35.84 64.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.072 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.6 8.33 25.71 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 64.47 168.34 0.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.355 0.598 . . . . 0.0 111.542 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 3.1 p90 -109.87 -177.16 3.19 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.435 -173.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.551 ' HB ' ' HD2' ' A' ' 129' ' ' PRO . 26.8 m -78.39 172.51 9.67 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.092 177.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.551 ' HD2' ' HB ' ' A' ' 128' ' ' VAL . 70.3 Cg_exo -54.43 94.34 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.383 2.056 . . . . 0.0 113.203 174.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -168.95 -171.14 1.27 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 174.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 59.0 mtt -118.35 102.05 8.65 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -79.62 111.01 15.49 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.1 mp -100.9 29.59 4.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.391 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.69 13.35 7.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.856 0.836 . . . . 0.0 109.252 178.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.533 ' H ' HD13 ' A' ' 135' ' ' ILE . 0.2 OUTLIER -74.69 17.73 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.323 177.921 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -91.17 41.83 2.88 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 177.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.61 111.85 0.8 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.31 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 5.7 m -70.78 102.53 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.934 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.74 93.91 6.29 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -91.46 97.22 10.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.795 -177.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -95.06 -86.77 0.29 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.546 176.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.9 t . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.337 177.656 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 N--CA 1.48 1.064 0 CA-C-O 120.764 0.316 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.626 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 96.9 Cg_endo -81.17 2.17 8.76 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.975 2.45 . . . . 0.0 113.206 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -50.11 -69.2 0.12 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.622 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.6 tp -73.45 -10.89 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.38 0.609 . . . . 0.0 111.101 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.626 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 77.0 mtp -79.31 -21.71 45.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.552 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -81.1 80.98 7.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.203 0.525 . . . . 0.0 109.601 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -62.12 134.09 56.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.356 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.0 mp -54.9 -45.86 74.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.807 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -63.9 -32.63 74.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.84 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -74.98 -35.97 62.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.147 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.93 -45.91 69.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.02 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -46.76 -77.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.565 170.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.09 38.66 32.53 Favored Glycine 0 C--N 1.342 0.884 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.173 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -63.81 -55.56 22.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.021 0.439 . . . . 0.0 110.613 -177.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.5 105.37 4.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -70.52 -37.15 74.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.711 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.74 -28.74 69.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.511 -178.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 17.8 mm-40 -88.66 -27.18 21.44 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.226 -173.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 t -74.51 -35.02 63.17 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 1.026 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -59.32 -51.28 70.63 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.425 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -73.76 -32.31 63.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.406 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -68.16 -44.82 75.1 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.633 0.254 . . . . 0.0 110.844 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.687 ' HB2' HD22 ' A' ' 25' ' ' LEU . 10.5 mt -83.43 -17.29 42.65 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.042 0.449 . . . . 0.0 110.677 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.0 t 66.05 37.97 5.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.587 -177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 1.026 HD23 ' HA ' ' A' ' 20' ' ' LYS . 2.2 mm? -51.04 135.75 28.72 Favored Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.139 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.9 Cg_exo -65.28 149.65 88.25 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.909 1.739 . . . . 0.0 109.504 166.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -60.13 -32.66 71.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.673 0.273 . . . . 0.0 111.017 -174.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 t -70.01 -40.54 75.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.907 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 43.7 t -71.44 -53.14 21.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.392 -176.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.712 HG21 ' HG2' ' A' ' 20' ' ' LYS . 9.9 p -60.34 -36.51 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.804 -178.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.34 -51.52 56.4 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.205 177.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -37.85 88.94 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.229 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.5 tp -54.36 -56.62 16.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.796 173.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -68.97 11.66 0.19 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -59.13 130.55 47.51 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 119.926 1.239 . . . . 0.0 110.12 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -70.34 -35.02 73.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.794 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -84.44 136.98 33.62 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.559 ' N ' ' HD2' ' A' ' 38' ' ' LYS . 3.3 mptp? -85.24 75.21 10.31 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.891 -171.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 17.4 t70 -44.04 -55.38 4.73 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.291 172.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.9 t70 75.28 35.5 0.57 Allowed 'General case' 0 C--N 1.348 0.529 0 CA-C-O 121.899 0.857 . . . . 0.0 110.386 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.483 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -77.67 178.01 7.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.828 175.804 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.9 t -84.61 114.8 25.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 174.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.7 ttm -66.71 102.22 0.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.833 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -99.44 -34.8 10.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.104 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.88 117.32 11.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.928 0.87 . . . . 0.0 110.791 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.712 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -47.94 -36.91 13.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.695 -1.593 . . . . 0.0 112.718 174.439 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 25' ' ' LEU . 3.3 mm? -68.5 -20.25 64.57 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.533 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.68 -55.6 4.72 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.27 -43.15 1.4 Allowed Glycine 0 CA--C 1.534 1.232 0 CA-C-N 115.021 -0.99 . . . . 0.0 114.629 167.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.429 ' HB3' HD13 ' A' ' 23' ' ' LEU . 3.2 m -79.61 -43.96 21.89 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.656 1.228 . . . . 0.0 112.174 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.53 ' HB2' HD11 ' A' ' 25' ' ' LEU . . . -71.08 -23.45 62.12 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 tp -73.12 -25.2 21.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.943 0.401 . . . . 0.0 110.305 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.5 43.63 3.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.24 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.6 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 30.7 p -94.55 -44.51 7.82 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.58 -177.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.409 ' O ' HD23 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.88 -46.86 88.93 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -171.019 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.77 -12.27 59.79 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.228 -174.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.541 HG23 HG11 ' A' ' 61' ' ' VAL . 89.4 m -83.75 -33.83 24.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.482 174.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 18.6 mmmt -75.08 -23.93 58.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.636 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.4 mm? -64.96 -65.14 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.054 174.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -177.41 116.68 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 -178.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.541 HG11 HG23 ' A' ' 57' ' ' THR . 12.7 p -167.3 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 122.133 0.968 . . . . 0.0 110.113 -177.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.654 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.3 m -107.59 116.89 52.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.419 -177.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -55.08 5.39 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.301 177.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 1.2 Cg_endo -91.17 -147.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.078 2.519 . . . . 0.0 112.605 -175.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -74.35 2.76 8.61 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -173.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 148.19 -61.35 0.44 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.303 -177.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 16.0 p30 -87.87 164.17 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.509 -178.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.529 ' O ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER 69.07 28.69 4.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 173.171 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.654 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.0 p80 -80.3 67.87 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.809 -0.557 . . . . 0.0 111.648 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -87.57 -48.43 7.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 110.085 176.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.54 -51.98 54.58 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.153 -176.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.42 -32.7 71.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.716 -0.242 . . . . 0.0 111.3 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.476 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -64.88 -36.07 83.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE3' HG12 ' A' ' 91' ' ' VAL . 4.4 mmmp? -79.74 -36.35 37.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.449 178.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.03 -40.96 95.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.345 176.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -63.57 -37.2 86.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.165 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -34.36 73.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.241 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.501 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.8 mtm -74.4 -35.78 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.13 -9.21 46.38 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.52 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.534 ' HB3' HD21 ' A' ' 8' ' ' LEU . 57.1 m-70 -141.07 89.27 2.23 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.687 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.19 -75.12 0.36 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.864 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.96 142.88 28.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.952 0.406 . . . . 0.0 111.63 -174.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.596 ' OD2' HG22 ' A' ' 85' ' ' THR . 2.3 p-10 -77.95 159.54 28.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 170.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -61.81 -42.31 98.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.132 -162.134 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.596 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.6 t -54.13 -27.92 36.45 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.85 177.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.623 ' HA ' ' HG2' ' A' ' 89' ' ' GLN . 75.7 mtp -85.28 -39.58 17.56 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.449 0.642 . . . . 0.0 109.909 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.666 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.78 -31.83 73.03 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.947 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -82.24 -26.39 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.051 -176.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 3.4 pt20 -78.22 -22.89 47.81 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.6 tp -75.01 -47.25 30.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.974 175.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.666 HG13 ' O ' ' A' ' 87' ' ' ALA . 32.0 m -57.9 -35.81 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 120.857 0.361 . . . . 0.0 111.44 -176.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -62.69 -43.93 97.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.521 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.28 -42.71 84.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.19 176.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 90' ' ' LEU . 55.9 mt -56.01 -48.14 79.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.122 0.487 . . . . 0.0 110.457 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.961 -175.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.56 -44.88 6.31 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.052 -172.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.9 m -73.09 -41.7 63.79 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 119.321 -0.371 . . . . 0.0 111.35 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 101' ' ' ALA . 4.0 tt0 -66.38 -29.48 69.66 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.982 173.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -63.71 -39.82 95.25 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.219 0.533 . . . . 0.0 109.951 173.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.7 m -99.58 15.93 24.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.001 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.413 ' HB2' ' HA ' ' A' ' 98' ' ' GLU . . . -77.45 147.73 75.99 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.272 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 70.3 Cg_exo -52.79 151.89 18.63 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.257 2.638 . . . . 0.0 112.606 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 13.9 Cg_exo -70.84 47.1 0.69 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.719 2.946 . . . . 0.0 112.907 -179.024 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -125.57 94.3 4.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.369 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -81.54 96.5 7.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.101 0.476 . . . . 0.0 111.74 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.517 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 11.6 t70 -112.84 113.81 26.06 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 168.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.579 ' HG2' ' H ' ' A' ' 108' ' ' CYS . 0.9 OUTLIER -33.63 -60.55 0.36 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 107' ' ' LYS . 5.9 t -91.19 -12.08 36.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.824 0.738 . . . . 0.0 112.16 -175.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 46' ' ' ARG . 2.9 ttp -81.29 -29.96 34.13 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-O 122.025 0.917 . . . . 0.0 111.525 -171.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.423 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.31 -39.11 78.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.565 -179.783 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -15.81 3.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.508 -1.224 . . . . 0.0 112.428 174.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.53 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -90.69 -38.57 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.3 OUTLIER -58.31 -38.26 76.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.056 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.589 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -80.86 -35.92 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.525 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.31 81.58 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.63 ' HA ' ' HD2' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.52 -19.91 60.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.608 0.718 . . . . 0.0 110.48 178.847 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.711 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 9.0 t -72.74 -26.4 61.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.583 172.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -80.3 -44.0 20.32 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.54 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.63 ' HD2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.48 -28.07 65.76 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.834 179.064 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.711 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -61.32 -50.15 74.11 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 171.132 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 124' ' ' LYS . 0.4 OUTLIER -59.18 -47.91 83.56 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 173.005 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -55.75 -35.7 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 118.18 0.446 . . . . 0.0 111.266 178.176 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.799 ' HD2' ' HA ' ' A' ' 132' ' ' ASP . 0.9 OUTLIER -70.9 -32.0 68.82 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.82 0.343 . . . . 0.0 111.01 177.002 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 121' ' ' GLU . 68.3 tttt -66.21 -28.29 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.262 176.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.9 mt -71.7 0.48 8.7 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.164 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 72.86 -56.41 0.66 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.758 . . . . 0.0 112.632 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -67.7 87.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.111 0.481 . . . . 0.0 111.913 -176.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.621 HG11 ' HA ' ' A' ' 123' ' ' HIS . 7.7 p -161.49 130.79 3.19 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.778 177.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 8.8 Cg_exo -73.61 44.1 0.87 Allowed 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.502 2.801 . . . . 0.0 113.355 -178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -159.88 135.15 8.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 25.3 ttt -55.8 135.4 51.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.274 0.559 . . . . 0.0 111.941 -177.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.799 ' HA ' ' HD2' ' A' ' 123' ' ' HIS . 5.5 p-10 -83.35 130.54 35.06 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.53 175.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -160.74 108.65 1.57 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 14.9 p -123.43 147.24 27.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 135' ' ' ILE . 3.7 mp -95.75 108.36 20.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -73.83 89.38 0.66 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.632 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -61.96 138.56 58.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.016 0.436 . . . . 0.0 111.221 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.54 93.91 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.274 174.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.6 tt -76.31 96.54 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 177.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -71.19 136.55 48.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.807 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -123.91 171.99 9.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.64 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.17 179.494 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.8 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 7.0 m . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.825 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.6 Cg_exo -59.69 -17.78 44.44 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 122.699 2.266 . . . . 0.0 114.377 -174.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.8 mp0 -45.68 -69.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.485 0.491 . . . . 0.0 111.341 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.6 tp -87.26 -9.48 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.709 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.825 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 17.4 tmm? -65.48 -36.17 83.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.923 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 6' ' ' LYS . 8.8 mtpm? -86.51 97.45 10.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.025 0.44 . . . . 0.0 110.212 177.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -67.36 140.68 57.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.141 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mp -58.82 -38.98 79.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.052 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -58.51 -35.84 72.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.969 0.414 . . . . 0.0 110.805 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -75.39 -33.73 61.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.526 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -68.87 -56.59 7.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.318 176.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -52.19 -77.3 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 176.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.55 36.93 59.52 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.564 -170.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -84.97 -40.45 16.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.048 0.452 . . . . 0.0 110.666 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.48 59.43 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.688 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.1 tpt -70.11 -39.71 75.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.196 0.522 . . . . 0.0 110.263 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -61.2 -30.14 70.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.809 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -88.78 -20.52 24.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.01 -0.676 . . . . 0.0 111.919 -174.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -75.21 -32.55 61.22 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 168.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.972 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 26.2 tptp -61.32 -47.92 83.74 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.443 175.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -72.77 -38.16 67.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.802 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -61.12 -41.71 97.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.895 0.378 . . . . 0.0 110.79 -176.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.485 ' HB3' HD11 ' A' ' 47' ' ' LEU . 12.9 mt -86.6 -10.89 52.95 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.722 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t 57.55 41.68 25.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.55 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.972 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 16.2 mt -51.28 119.82 13.34 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.878 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.7 Cg_exo -72.24 157.94 52.77 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.751 2.301 . . . . 0.0 110.815 171.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.559 ' HA ' HG22 ' A' ' 30' ' ' VAL . 7.7 p-10 -65.17 -27.22 68.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -175.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.1 m -68.82 -39.64 79.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.902 0.382 . . . . 0.0 110.516 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.868 HG21 HD23 ' A' ' 47' ' ' LEU . 58.0 t -72.33 -44.52 63.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 27' ' ' ASP . 11.1 m -59.87 -31.7 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 110.566 175.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.65 -52.12 58.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.948 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -67.34 -36.37 81.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.32 -56.93 13.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.365 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -69.04 10.56 0.28 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -66.27 103.81 1.07 Allowed 'General case' 0 C--N 1.344 0.344 0 CA-C-N 120.108 1.322 . . . . 0.0 110.178 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -71.0 -32.37 69.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.109 -175.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -90.23 101.9 14.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.586 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.501 ' NZ ' ' HB2' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -72.64 79.69 1.09 Allowed 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.599 0.714 . . . . 0.0 110.443 179.248 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.81 12.89 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.49 -1.232 . . . . 0.0 114.056 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.0 t70 60.02 70.89 0.6 Allowed 'General case' 0 C--N 1.343 0.321 0 CA-C-N 118.695 0.68 . . . . 0.0 110.176 -168.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -115.52 176.35 5.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.762 177.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.7 t -108.89 121.62 62.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.1 ttm -77.68 100.65 6.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.4 p -94.21 -29.92 14.85 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.165 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -78.0 115.06 17.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.677 0.751 . . . . 0.0 110.13 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.915 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -57.27 -35.2 69.48 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.921 174.527 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.868 HD23 HG21 ' A' ' 29' ' ' VAL . 56.5 tp -64.92 -17.81 64.67 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 120.978 0.418 . . . . 0.0 110.795 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.67 1.8 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.03 -45.66 2.24 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 115.215 -0.902 . . . . 0.0 114.672 166.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 86.7 m -64.33 -42.64 96.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.307 1.053 . . . . 0.0 110.408 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.85 -25.11 67.76 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.646 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.1 mt -73.35 -35.57 46.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.188 0.518 . . . . 0.0 110.164 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -104.75 44.74 1.0 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.431 -175.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t -112.27 -47.95 3.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.94 -52.06 58.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.34 0.59 . . . . 0.0 111.037 -170.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -80.92 -11.58 59.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.273 -173.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.636 ' HA ' HG11 ' A' ' 61' ' ' VAL . 22.5 m -83.36 -35.25 25.28 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.525 175.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -78.1 -17.35 57.04 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.405 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mt -64.91 -66.96 0.48 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.57 172.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -178.29 121.75 0.1 Allowed 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.636 HG11 ' HA ' ' A' ' 57' ' ' THR . 11.9 p -176.63 34.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.906 0.86 . . . . 0.0 111.082 -175.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.536 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 33.6 m -108.52 115.5 49.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 O-C-N 121.158 -0.964 . . . . 0.0 111.422 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.22 -55.84 2.11 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.009 178.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 15.9 Cg_endo -97.47 -140.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.984 2.456 . . . . 0.0 113.165 -171.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.485 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 16.4 m-20 -72.89 6.71 2.41 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.48 -174.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.17 -75.35 0.43 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 5.1 p30 -69.52 153.76 43.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.939 -0.63 . . . . 0.0 111.039 176.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' A' ' 68' ' ' LEU . 4.2 mm? 69.82 32.87 3.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.587 173.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.5 p-80 -73.73 76.28 1.56 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.388 0.613 . . . . 0.0 110.71 171.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -86.39 -59.12 2.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.699 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.7 -52.36 53.52 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.216 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -58.13 -34.4 70.21 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.832 -0.184 . . . . 0.0 111.458 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.601 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -67.83 -36.45 80.37 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.3 0.572 . . . . 0.0 111.184 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.5 mmmt -80.03 -37.66 33.61 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.61 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.28 -40.6 96.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.27 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 51.7 t80 -61.49 -40.56 95.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.45 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.28 73.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.96 0.41 . . . . 0.0 111.179 -178.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 53.0 mtt -74.34 -23.7 59.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.088 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -85.88 -15.49 41.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.732 -176.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -146.89 96.71 2.79 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.076 -176.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.54 -71.47 0.22 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.379 -0.915 . . . . 0.0 112.658 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.736 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.06 139.99 31.33 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.487 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.496 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.3 OUTLIER -84.04 166.18 17.94 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.361 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.46 -25.61 63.26 Favored 'General case' 0 N--CA 1.416 -2.168 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.414 -167.564 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.787 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.6 OUTLIER -73.87 -31.11 63.0 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.121 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 9.3 tpp -78.54 -48.0 16.14 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.82 0.819 . . . . 0.0 108.946 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.582 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -58.73 -36.7 74.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.409 176.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.704 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.14 -25.66 61.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.91 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 85' ' ' THR . 14.2 mm-40 -77.77 -25.3 49.0 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.5 tt -87.89 -43.62 11.66 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.862 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 88' ' ' GLN . 4.8 m -60.9 -27.89 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -66.47 -41.14 89.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.462 0.649 . . . . 0.0 109.861 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.531 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -66.46 -39.34 83.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 176.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 90' ' ' LEU . 49.3 mt -57.99 -47.39 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.146 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -69.71 -34.88 74.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.55 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.22 -53.09 3.77 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.058 -1.068 . . . . 0.0 112.515 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.7 m -72.42 -32.18 66.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.539 ' OE2' ' HE2' ' A' ' 110' ' ' LYS . 40.3 tt0 -67.21 -34.72 78.08 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.122 0.874 . . . . 0.0 110.114 173.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -63.67 -41.2 98.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.923 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.1 m -103.06 19.57 19.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.72 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.41 155.7 83.72 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.902 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 71.9 Cg_exo -48.41 135.84 26.01 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.692 2.261 . . . . 0.0 111.636 174.568 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.2 Cg_exo -70.51 49.32 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 123.686 2.924 . . . . 0.0 113.498 -176.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -125.35 94.37 4.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 173.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -81.13 84.96 6.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.087 -171.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.662 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.7 t70 -106.94 133.47 51.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.587 176.136 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -30.05 -75.28 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.712 1.258 . . . . 0.0 113.711 -175.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.915 ' HB2' ' HB2' ' A' ' 46' ' ' ARG . 98.1 m -88.63 -10.29 49.13 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.662 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -69.61 -41.17 76.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 -173.557 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HE2' ' OE2' ' A' ' 98' ' ' GLU . 14.3 ptmt -65.19 -51.0 63.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.778 0.799 . . . . 0.0 110.373 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.538 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -59.56 -14.27 12.49 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.575 174.085 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.59 -36.31 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 177.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -63.42 -35.26 79.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.356 176.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 16.0 m -76.36 -37.08 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.985 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.21 78.5 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.308 0.575 . . . . 0.0 111.367 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.624 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.2 ptt? -69.09 -17.68 63.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.281 178.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 31.8 t -73.54 -30.03 62.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.835 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -77.64 -43.23 32.12 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.585 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.578 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -70.42 -23.42 62.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.903 176.576 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.624 ' HE3' ' O ' ' A' ' 116' ' ' MET . 1.1 ttmt -62.23 -48.29 80.63 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 121.353 -0.842 . . . . 0.0 110.095 170.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -59.14 -45.0 92.09 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 119' ' ' LYS . 11.8 tt -58.92 -33.41 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-N 118.799 0.727 . . . . 0.0 110.675 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' HIS . . . . . 0.47 ' CE1' ' HD3' ' A' ' 119' ' ' LYS . 1.2 m80 -71.1 -31.43 67.79 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.448 174.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -66.39 -35.28 79.93 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.527 0.331 . . . . 0.0 111.552 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 122' ' ' ILE . 0.6 OUTLIER -85.28 10.66 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -179.067 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 68.86 110.98 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.559 0.695 . . . . 0.0 111.236 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.4 p-90 -112.47 -176.78 2.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.493 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 16.8 m -119.48 131.43 24.39 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.476 177.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 23.7 Cg_exo -63.93 159.19 43.34 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.001 2.467 . . . . 0.0 112.802 -176.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -105.0 153.0 22.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.05 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.85 -174.13 3.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -71.28 119.27 15.18 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.182 178.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.543 HD13 HG22 ' A' ' 134' ' ' VAL . 0.4 OUTLIER -101.54 76.45 1.67 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.096 -178.659 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.543 HG22 HD13 ' A' ' 133' ' ' LEU . 17.3 m 35.56 75.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 124.176 0.99 . . . . 0.0 113.466 178.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.927 ' H ' HD13 ' A' ' 135' ' ' ILE . 0.2 OUTLIER -78.71 102.15 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.844 0.831 . . . . 0.0 110.501 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -73.07 160.81 54.17 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 114.777 -1.101 . . . . 0.0 112.345 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -115.43 114.13 24.65 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.009 0.433 . . . . 0.0 110.152 -177.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 79.7 t -96.17 121.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.762 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.9 tt -88.92 110.24 20.92 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -79.15 106.37 11.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.637 -178.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -125.13 143.11 51.09 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.866 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.208 179.688 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.62 0.248 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -86.56 -1.71 8.33 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.963 2.442 . . . . 0.0 112.402 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -45.17 -68.11 0.23 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.173 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.0 tt -83.14 -9.62 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-O 121.002 0.429 . . . . 0.0 111.433 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.2 mmm -66.64 -26.02 66.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.203 0.525 . . . . 0.0 109.799 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -92.93 102.47 14.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.234 166.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -62.92 130.05 43.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 110.888 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 89.6 mt -65.18 -45.04 86.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.598 -176.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 m -60.5 -40.57 91.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.769 0.319 . . . . 0.0 110.771 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -75.89 -24.25 55.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.083 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.0 t-20 -73.43 -50.79 19.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 175.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 34.9 m-85 -50.24 -77.99 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.353 173.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.44 38.52 62.89 Favored Glycine 0 C--N 1.343 0.954 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.717 -177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -68.12 -36.79 80.29 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 117.295 0.547 . . . . 0.0 110.512 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.29 101.52 3.13 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.629 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 50.9 ttm -70.15 -34.43 73.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.105 0.479 . . . . 0.0 109.805 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.35 -38.73 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.279 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -88.29 -25.99 22.51 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.644 -172.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t -75.53 -35.5 60.71 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -47.94 81.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.883 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.73 -37.31 41.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.832 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.52 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 33.9 tp10 -61.45 -41.47 97.26 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.348 0.118 . . . . 0.0 111.025 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 mm? -79.05 -22.48 45.3 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.325 172.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.2 m 58.44 50.54 9.23 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -170.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.642 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 25.4 mt -66.56 121.5 77.49 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.969 -171.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' CG2' ' A' ' 29' ' ' VAL . 11.8 Cg_exo -73.3 154.82 51.5 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.558 2.172 . . . . 0.0 110.841 171.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.638 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.0 p-10 -63.54 -23.6 67.46 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 m -65.79 -39.05 90.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.423 0.63 . . . . 0.0 109.85 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.557 ' CG2' ' HD2' ' A' ' 26' ' ' PRO . 58.9 t -70.57 -51.79 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.483 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.638 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.9 m -57.68 -30.51 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.167 0.508 . . . . 0.0 110.731 179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.86 -52.23 57.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.63 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.71 -35.68 65.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.804 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 19.3 tp -50.53 -55.46 15.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.793 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.418 ' HD1' ' O ' ' A' ' 30' ' ' VAL . 20.4 m-85 -77.41 11.45 1.97 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -175.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -58.85 111.39 1.27 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 118.28 0.491 . . . . 0.0 109.873 176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -79.05 -17.33 55.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.513 -171.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -91.03 124.71 35.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.633 0.254 . . . . 0.0 110.897 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -75.96 65.46 2.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.736 179.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.718 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 36.5 t70 -54.89 -19.09 5.84 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.771 1.767 . . . . 0.0 115.771 178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.9 t70 62.63 70.61 0.55 Allowed 'General case' 0 C--N 1.348 0.517 0 CA-C-N 119.717 1.144 . . . . 0.0 109.59 -169.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.0 p90 -114.75 165.77 12.46 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.375 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.32 117.31 31.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.5 ttm -75.1 102.05 4.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.364 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -107.43 -16.69 14.31 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -77.98 130.94 37.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.479 . . . . 0.0 110.289 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.884 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 3.4 mpt_? -69.99 -27.07 64.41 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.297 -171.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.7 mm? -80.42 -15.73 56.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.053 -173.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.412 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.34 -61.12 2.03 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.0 -47.69 1.92 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.073 168.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 m -70.79 -42.5 70.26 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.448 1.124 . . . . 0.0 112.042 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.19 -6.28 38.33 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -177.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 48' ' ' ALA . 45.3 mm -57.02 -30.22 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.142 0.496 . . . . 0.0 110.151 172.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 23.0 p-10 -145.49 86.14 1.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.162 -179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' CYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.0 p -112.72 -47.93 3.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -177.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 52.7 tp -64.53 -55.41 20.74 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.076 0.465 . . . . 0.0 112.083 -170.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.29 -13.79 58.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.958 0.408 . . . . 0.0 110.268 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.617 HG23 HG11 ' A' ' 61' ' ' VAL . 30.5 m -74.54 -34.85 63.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.493 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.52 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 17.5 mmmt -81.17 -24.72 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.222 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 66.5 mt -64.74 -61.81 1.96 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.135 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -175.09 112.78 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.545 0.212 . . . . 0.0 110.802 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.617 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -170.3 32.24 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 121.969 0.89 . . . . 0.0 110.091 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.548 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 19.2 m -105.25 120.49 56.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 O-C-N 121.808 -0.557 . . . . 0.0 110.926 -175.192 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.404 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 1.9 t0 -75.39 -55.51 2.12 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.674 175.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.665 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.5 Cg_endo -97.26 -143.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 123.112 2.541 . . . . 0.0 113.071 -172.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 7.6 t70 -72.22 -1.34 14.78 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.593 -175.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 144.14 -68.84 0.42 Allowed Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.164 -0.774 . . . . 0.0 111.164 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.665 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 4.5 p30 -75.35 149.76 38.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.885 -0.657 . . . . 0.0 111.202 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.28 37.66 2.03 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.017 172.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.585 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.3 p80 -72.6 80.63 1.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.304 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 28.6 p-80 -87.39 -59.82 2.14 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.8 -63.48 4.58 Favored Glycine 0 N--CA 1.462 0.368 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.296 -170.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -57.47 -24.62 56.85 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -177.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -74.37 -36.07 63.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.435 0.636 . . . . 0.0 111.144 178.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.634 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.1 mmmt -79.48 -33.63 42.06 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.71 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.578 172.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 87.7 t80 -57.28 -37.11 71.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.354 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.89 75.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.858 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 54.1 mtt -66.86 -36.24 81.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.901 -175.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -87.63 -14.92 38.73 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.111 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -136.65 89.57 2.47 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.021 -175.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.1 -62.04 0.3 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.077 -1.058 . . . . 0.0 112.361 171.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.95 132.16 35.98 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 121.134 0.492 . . . . 0.0 110.833 -177.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.76 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 91.5 m-20 -75.01 149.42 39.27 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.97 -33.52 64.87 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.884 -174.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.39 -26.4 60.08 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 122.344 -0.223 . . . . 0.0 110.94 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' MET . . . . . 0.76 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 17.9 mtm -86.38 -38.48 17.36 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -174.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.509 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -63.73 -42.6 97.88 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.883 175.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.489 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -75.58 -25.61 57.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -176.123 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.97 -23.89 44.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.607 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' ILE . 60.0 tp -86.51 -48.17 8.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.244 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.489 HG22 ' HA ' ' A' ' 88' ' ' GLN . 16.8 m -57.69 -36.34 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.307 -174.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.02 -42.05 97.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.974 0.416 . . . . 0.0 110.091 -177.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.774 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mm -65.79 -42.34 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.896 175.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.502 HG13 ' O ' ' A' ' 90' ' ' LEU . 58.5 mt -55.43 -47.42 78.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.965 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -70.06 -34.29 73.03 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.439 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -44.07 7.06 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.301 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.782 ' HB2' HG12 ' A' ' 114' ' ' VAL . 68.6 m -72.56 -34.4 67.46 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.539 ' HG3' HG11 ' A' ' 114' ' ' VAL . 8.3 mt-10 -64.52 -37.54 87.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.436 0.562 . . . . 0.0 111.069 170.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -67.38 -41.88 84.32 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.821 0.343 . . . . 0.0 110.512 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.4 m -94.68 14.41 21.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.924 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -80.76 150.43 69.44 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.91 159.94 50.97 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 122.606 2.204 . . . . 0.0 110.567 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.12 84.77 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.337 2.024 . . . . 0.0 111.232 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -126.29 108.81 11.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.992 -176.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -83.37 26.69 0.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -169.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.465 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 2.8 p30 -89.73 105.29 17.71 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 122.467 1.127 . . . . 0.0 111.642 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.5 tttp -29.28 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 114.674 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -84.61 -9.97 57.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.659 0.266 . . . . 0.0 111.525 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.884 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 91.7 mmm -85.12 -21.37 29.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -172.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -57.69 -45.31 85.83 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 122.095 0.95 . . . . 0.0 109.975 177.599 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.568 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.38 -12.49 3.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.261 174.227 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.3 mp -89.52 -38.85 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 13.8 m-20 -60.67 -36.94 79.99 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.767 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' VAL . . . . . 0.782 HG12 ' HB2' ' A' ' 97' ' ' CYS . 10.9 m -76.77 -38.21 29.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.91 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.06 -49.08 77.39 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 121.448 0.642 . . . . 0.0 111.546 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' MET . . . . . 0.692 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.13 -23.46 63.97 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.766 179.034 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' CYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 9.3 t -69.43 -26.74 64.75 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 123.344 0.658 . . . . 0.0 109.529 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -75.3 -46.92 30.43 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.262 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.4 ' HA ' ' HB ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -68.53 -25.63 65.02 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 118.345 -1.342 . . . . 0.0 111.15 178.522 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.692 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.37 -56.56 18.75 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 109.878 168.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.483 ' HG3' HD11 ' A' ' 93' ' ' ILE . 20.4 mm-40 -59.94 -42.73 94.66 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.507 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.4 ' HB ' ' HA ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -56.52 -34.19 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 118.126 0.421 . . . . 0.0 111.351 177.235 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -31.93 66.34 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.088 -0.383 . . . . 0.0 111.39 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -69.53 -30.54 68.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.269 0.556 . . . . 0.0 110.419 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 97.8 mt -72.58 10.34 0.86 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.202 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -51.45 -48.25 62.83 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.373 0.269 . . . . 0.0 111.456 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.85 109.39 4.99 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-O 120.773 0.32 . . . . 0.0 110.213 177.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 27.7 m -96.99 151.95 38.04 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.583 178.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.19 -25.88 72.5 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.487 2.125 . . . . 0.0 111.585 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 63.9 t30 70.12 11.37 7.59 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.159 174.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.5 mmt -135.66 93.79 3.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.733 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -91.36 160.82 15.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.551 HD13 ' N ' ' A' ' 133' ' ' LEU . 0.0 OUTLIER -127.4 131.57 50.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.738 0.78 . . . . 0.0 111.358 -177.392 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.443 ' O ' ' HB ' ' A' ' 135' ' ' ILE . 3.1 m -134.84 116.68 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.827 -177.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ILE . . . . . 0.443 ' HB ' ' O ' ' A' ' 134' ' ' VAL . 3.3 mp 73.93 111.12 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.037 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -118.27 12.43 12.64 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.898 -0.668 . . . . 0.0 111.886 178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 156.85 27.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.811 0.338 . . . . 0.0 110.748 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.63 112.57 22.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.058 -175.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.98 110.63 13.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -102.6 148.61 25.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.172 -177.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -141.99 137.95 31.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.331 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 45.1 t . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.253 -178.513 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.651 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.9 Cg_endo . . . . . 0 C--O 1.232 0.221 0 N-CA-C 112.855 0.29 . . . . 0.0 112.855 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.01 -69.07 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.568 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.46 HD12 ' HA ' ' A' ' 4' ' ' ILE . 6.6 tp -80.61 -9.71 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 121.132 0.491 . . . . 0.0 111.638 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.651 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 78.4 mtp -73.98 -21.18 60.09 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.47 176.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -74.1 91.68 2.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -73.04 131.84 42.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.52 -174.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 71.6 mt -55.99 -47.49 77.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.124 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.624 ' HB3' HD23 ' A' ' 55' ' ' LEU . 49.2 m -61.89 -29.97 70.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.438 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -75.27 -36.04 61.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.422 . . . . 0.0 110.295 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -68.71 -52.65 28.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.985 178.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -51.41 -78.01 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 173.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 55.5 35.49 61.74 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.631 -175.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -75.65 -41.17 54.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.071 0.436 . . . . 0.0 111.42 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.91 99.36 3.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.861 0.362 . . . . 0.0 111.227 -173.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.33 -46.68 14.35 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.255 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.07 -30.74 71.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.948 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -87.82 -21.99 24.74 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.727 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.2 t -75.21 -34.97 61.53 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 167.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.793 ' HA ' HD13 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -61.16 -45.58 94.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.897 178.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -71.16 -40.37 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.788 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.632 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 30.6 tp10 -60.09 -44.07 95.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.373 -0.131 . . . . 0.0 111.042 -173.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.726 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.4 mt -88.44 -8.58 54.7 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.496 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.5 m 57.68 37.57 27.36 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.133 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.793 HD13 ' HA ' ' A' ' 20' ' ' LYS . 5.0 mp -54.08 121.53 30.62 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.293 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.96 155.4 68.24 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.191 1.927 . . . . 0.0 110.878 172.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.68 -31.98 71.21 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.7 p -63.8 -40.4 96.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.707 0.289 . . . . 0.0 111.444 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.5 t -76.21 -55.73 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.643 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -59.61 -28.79 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.935 0.398 . . . . 0.0 110.865 -176.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.56 -51.43 35.49 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.29 -35.98 82.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.318 0.58 . . . . 0.0 110.031 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -38.62 69.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.395 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -78.54 8.9 4.53 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.473 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 43.7 t30 -65.65 107.74 1.84 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.709 0.686 . . . . 0.0 109.747 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -81.16 -18.38 46.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.227 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.473 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 30.4 m-90 -73.45 131.71 42.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -80.71 53.29 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.125 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.571 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 37.7 t70 -43.73 -42.67 5.55 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 172.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.4 t70 66.36 61.31 0.59 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-O 121.716 0.769 . . . . 0.0 109.929 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.571 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -97.28 177.32 5.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.107 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.2 t -84.29 126.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.74 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 37.5 ttm -67.11 103.46 1.2 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.0 p -101.72 -26.74 13.39 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -173.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 15.3 t70 -101.62 122.51 44.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.69 0.757 . . . . 0.0 112.493 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 1.023 ' HB2' ' HB3' ' A' ' 108' ' ' CYS . 0.1 OUTLIER -47.59 -40.94 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.132 172.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.807 HD22 ' HG2' ' A' ' 46' ' ' ARG . 2.9 mm? -65.87 -19.24 65.81 Favored 'General case' 0 C--N 1.333 -0.144 0 O-C-N 122.021 -0.425 . . . . 0.0 111.068 -176.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.08 -61.24 1.96 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -39.12 -48.13 2.65 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 114.688 -1.142 . . . . 0.0 114.504 168.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.5 m -67.31 -41.95 84.51 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.405 1.102 . . . . 0.0 111.674 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -63.24 -23.86 67.61 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.9 mt -58.09 -39.23 71.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.992 0.425 . . . . 0.0 110.946 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.489 ' O ' ' HB ' ' A' ' 57' ' ' THR . 3.7 p-10 -113.84 42.84 1.93 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.481 0.658 . . . . 0.0 110.16 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 10.6 t -98.75 -46.4 5.69 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.656 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 9' ' ' SER . 4.4 mm? -60.31 -55.88 28.24 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 111.963 -174.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.09 -16.62 49.41 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.909 -172.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 53' ' ' ASN . 18.1 m -84.93 -42.37 15.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.372 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.632 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 5.8 mmmt -72.76 -15.97 61.65 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.373 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.84 -65.92 0.61 Allowed 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 172.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -176.28 119.14 0.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.056 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.466 ' CG1' HG23 ' A' ' 57' ' ' THR . 9.2 p -175.62 31.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 121.54 0.686 . . . . 0.0 111.327 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.545 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 32.9 m -93.34 118.72 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 O-C-N 121.147 -0.971 . . . . 0.0 111.401 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.31 -53.27 10.67 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.505 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.681 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -98.99 -143.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 123.345 2.696 . . . . 0.0 112.999 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 6.3 p-10 -72.21 -5.72 37.8 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.633 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 151.41 -60.96 0.41 Allowed Glycine 0 C--N 1.316 -0.572 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.681 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -85.36 165.48 17.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.815 -0.692 . . . . 0.0 109.817 176.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.09 29.79 4.62 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.308 0.575 . . . . 0.0 111.308 171.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.577 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 9.2 p80 -73.4 74.3 1.38 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.192 0.52 . . . . 0.0 111.794 177.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -86.38 -50.86 6.6 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.13 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.4 -61.71 6.58 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.948 -172.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -56.68 -31.08 64.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.67 -37.95 76.89 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.219 0.533 . . . . 0.0 110.968 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -79.73 -35.59 38.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.0 -40.96 95.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.457 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -63.57 -38.78 92.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.663 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.09 78.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.066 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 72.0 mtm -73.63 -23.46 59.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.812 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -93.22 -14.26 27.31 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.935 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -144.99 95.41 2.68 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 120.742 0.306 . . . . 0.0 111.042 -177.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.38 -70.11 0.42 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.236 173.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -103.72 135.4 45.34 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.4 ' OD1' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -80.21 172.56 13.61 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.197 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -23.25 67.16 Favored 'General case' 0 N--CA 1.422 -1.872 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.604 -167.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 1.2 t -73.19 -30.9 63.86 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.481 -177.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.581 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 71.9 mtp -81.93 -41.2 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.376 0.608 . . . . 0.0 109.362 -175.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.583 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -62.29 -33.23 74.25 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.235 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.74 -21.45 51.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.25 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.816 ' HG2' ' O ' ' A' ' 85' ' ' THR . 10.6 mm-40 -77.74 -25.31 49.14 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 172.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.2 mp -85.45 -42.94 14.03 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.604 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.583 HG13 ' O ' ' A' ' 87' ' ' ALA . 29.8 m -56.91 -32.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.86 0.362 . . . . 0.0 111.809 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.17 -44.91 78.52 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.601 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.636 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.5 mp -67.62 -43.75 86.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 50.0 mt -52.67 -48.7 48.16 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.786 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -71.7 -36.54 70.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.196 -174.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.33 -44.4 6.6 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 119.722 -1.228 . . . . 0.0 112.367 -172.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.739 ' HB2' HG12 ' A' ' 114' ' ' VAL . 38.7 m -72.23 -41.11 67.2 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.854 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.501 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.4 tt0 -63.89 -38.79 92.4 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 117.948 0.34 . . . . 0.0 110.798 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -67.14 -34.46 77.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 m -95.79 5.34 51.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.259 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.33 149.44 78.91 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.719 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.474 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 22.7 Cg_exo -65.37 144.53 80.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.731 2.287 . . . . 0.0 111.195 178.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 7.9 Cg_exo -73.37 35.52 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.425 2.75 . . . . 0.0 113.314 -175.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -76.77 112.08 12.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -77.75 96.22 4.85 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -167.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.74 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.0 t0 -144.04 100.73 3.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 163.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -40.77 -44.75 2.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' A' ' 46' ' ' ARG . 4.1 t -88.06 -24.58 23.41 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.583 1.083 . . . . 0.0 112.232 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.74 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 75.4 mmm -74.76 -26.39 59.73 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.987 -0.445 . . . . 0.0 111.884 -175.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.556 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -60.14 -43.03 96.04 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.766 0.793 . . . . 0.0 110.032 178.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.556 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.03 -14.9 7.46 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.35 174.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.565 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.5 mp -89.95 -38.0 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 14.4 t70 -60.06 -34.11 72.97 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.432 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.739 HG12 ' HB2' ' A' ' 97' ' ' CYS . 14.0 m -80.57 -39.47 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.574 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.75 -49.64 76.68 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.323 0.582 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.718 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.84 -24.67 63.49 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.305 178.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.4 t -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.171 0.51 . . . . 0.0 110.137 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.568 ' HA ' HG12 ' A' ' 93' ' ' ILE . 73.7 t80 -79.65 -45.87 18.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.123 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -69.27 -28.8 66.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.71 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.718 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.54 -51.06 71.48 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.916 0.389 . . . . 0.0 110.452 170.349 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -57.52 -54.9 41.64 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.67 177.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.14 -32.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 120.699 0.285 . . . . 0.0 111.44 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -71.22 -30.63 66.59 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.625 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.28 -33.07 67.17 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.56 172.471 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.679 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 18.5 Cg_endo . . . . . 0 N--CA 1.475 0.404 0 N-CA-C 114.384 0.878 . . . . 0.0 114.384 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.5 -69.13 0.12 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.72 0.295 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.88 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.2 mm -80.16 -15.08 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-O 121.092 0.472 . . . . 0.0 111.676 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.679 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 13.4 tmm? -64.64 -38.2 90.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.016 0.436 . . . . 0.0 110.267 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -93.45 120.38 33.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.36 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -71.79 133.83 45.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.789 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.604 HD11 ' O ' ' A' ' 80' ' ' HIS . 50.7 mt -57.7 -43.15 84.97 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.035 0.209 . . . . 0.0 110.914 178.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.0 m -61.79 -38.72 89.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.897 0.379 . . . . 0.0 110.763 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -75.47 -34.56 60.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.4 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -67.19 -54.05 24.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.678 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HD2' ' O ' ' A' ' 8' ' ' LEU . 32.9 m-85 -47.45 -73.02 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.459 168.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.01 40.23 58.18 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.306 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.459 ' C ' ' HD3' ' A' ' 14' ' ' LYS . 12.2 tmtt? -67.48 -58.14 5.27 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.1 90.46 1.36 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.684 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 64.6 mtt -71.62 -27.19 62.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.251 0.548 . . . . 0.0 109.773 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 37.3 t70 -62.27 -24.69 67.42 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.799 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -88.13 -25.14 23.14 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.197 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.6 t -76.13 -36.58 58.74 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.76 -42.09 97.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.462 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -71.3 -42.85 68.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.088 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -70.24 -41.46 73.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.352 -174.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' A' ' 25' ' ' LEU . 15.3 mt -83.48 1.17 43.1 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.972 0.415 . . . . 0.0 111.291 -177.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.8 m 67.38 31.92 6.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.721 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' A' ' 23' ' ' LEU . 8.4 mp -62.15 121.4 65.78 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.724 175.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 12.5 Cg_exo -71.07 160.22 49.91 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.89 2.393 . . . . 0.0 111.167 173.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.767 ' HA ' HG22 ' A' ' 30' ' ' VAL . 4.6 p-10 -69.4 -16.42 63.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.34 -176.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 p -64.85 -48.83 72.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 0.0 110.341 174.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.2 t -71.0 -45.82 70.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.256 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.767 HG22 ' HA ' ' A' ' 27' ' ' ASP . 14.9 m -59.28 -30.04 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.975 0.417 . . . . 0.0 110.043 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.54 -52.19 54.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.798 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.02 -36.11 81.38 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.104 0.478 . . . . 0.0 110.202 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -54.99 25.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.177 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -66.95 11.08 0.11 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -64.36 118.27 8.46 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.02 1.282 . . . . 0.0 110.063 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -92.55 -36.33 13.09 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -77.39 151.18 34.94 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.217 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -80.13 60.24 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.951 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -55.49 -36.33 66.52 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.713 171.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.1 t0 59.41 70.92 0.61 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.51 0.671 . . . . 0.0 110.087 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.414 ' O ' ' HD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.22 164.66 11.57 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.68 -179.283 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.2 t -85.44 115.16 26.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 173.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.617 ' O ' HG21 ' A' ' 112' ' ' ILE . 39.4 ttp -72.49 99.08 2.41 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.028 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.8 p -110.48 -9.99 14.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.839 -175.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -80.41 134.22 35.98 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.851 0.834 . . . . 0.0 110.443 178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.723 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 6.2 mpt_? -72.99 -29.12 62.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.227 -1.352 . . . . 0.0 110.681 -170.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB3' ' HG ' ' A' ' 25' ' ' LEU . 3.3 mm? -76.13 -15.25 60.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.495 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.582 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -84.46 -58.73 2.62 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.8 -47.53 1.8 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.187 -0.915 . . . . 0.0 114.096 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.423 ' HB3' HD13 ' A' ' 23' ' ' LEU . 7.3 m -66.55 -43.93 83.72 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.292 1.046 . . . . 0.0 111.641 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.705 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -67.82 -23.97 65.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.87 0.367 . . . . 0.0 111.861 -177.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 48' ' ' ALA . 37.2 mm -65.6 -32.41 58.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.981 0.42 . . . . 0.0 110.835 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -132.12 53.7 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.499 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.576 ' SG ' HD12 ' A' ' 55' ' ' LEU . 25.8 p -115.16 -44.05 3.04 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.59 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' SG ' ' A' ' 54' ' ' CYS . 9.0 mp -54.52 -44.0 72.4 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.197 0.523 . . . . 0.0 111.534 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.407 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -79.8 -11.74 59.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.318 -173.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.806 ' HA ' ' CG1' ' A' ' 61' ' ' VAL . 13.2 m -83.63 -33.17 25.35 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.646 0.736 . . . . 0.0 110.211 174.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 13.3 mmmt -71.26 -31.48 67.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.249 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.95 -67.07 0.47 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.72 172.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -178.97 123.21 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.546 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.806 ' CG1' ' HA ' ' A' ' 57' ' ' THR . 7.9 p -177.42 32.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.431 0.634 . . . . 0.0 112.171 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.537 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.1 m -101.34 123.22 54.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.691 -1.256 . . . . 0.0 111.42 -177.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.462 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 12.3 t70 -73.5 -54.29 4.09 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.891 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.74 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 57.0 Cg_endo -104.62 -139.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 123.398 2.732 . . . . 0.0 113.066 -171.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.52 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 18.3 m-20 -73.25 3.0 6.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.673 -175.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.41 -75.47 0.33 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.785 -0.722 . . . . 0.0 111.35 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.697 HD22 HD23 ' A' ' 68' ' ' LEU . 1.2 p-10 -76.53 157.05 32.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.183 -0.508 . . . . 0.0 110.742 177.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.697 HD23 HD22 ' A' ' 67' ' ' ASN . 4.3 mm? 69.49 34.17 2.89 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.585 0.553 . . . . 0.0 111.22 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.74 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.7 p80 -73.71 79.98 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.439 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -87.69 -57.25 3.01 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.424 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.12 -63.08 5.03 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.086 -169.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -59.36 -22.86 61.96 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.435 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -72.7 -33.83 66.74 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.965 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 29.8 mmmt -78.82 -31.62 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.059 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -64.96 -39.97 94.29 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.407 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 88.7 t80 -61.64 -36.89 82.08 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.704 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.17 -40.85 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.828 0.346 . . . . 0.0 110.991 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.563 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 73.9 mtm -75.18 -19.76 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.199 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -90.13 -16.26 29.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.231 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.604 ' O ' HD11 ' A' ' 8' ' ' LEU . 52.9 m-70 -143.27 96.34 2.9 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.653 0.263 . . . . 0.0 110.37 -175.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.85 -62.64 0.3 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.125 172.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.88 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.43 139.74 38.93 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.046 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.474 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.7 OUTLIER -82.25 169.02 17.03 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 168.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 12.2 pt-20 -68.09 -22.65 64.9 Favored 'General case' 0 N--CA 1.409 -2.487 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.298 -165.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.474 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.4 t -73.22 -29.43 62.79 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.08 -175.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 61.1 mtm -87.22 -38.82 16.01 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.61 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.21 -37.64 80.93 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.321 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -77.2 -21.85 53.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.275 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -77.23 -22.12 52.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.027 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 94' ' ' ILE . 28.8 tp -88.26 -39.38 14.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.65 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.2 m -57.59 -35.92 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -171.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.71 -38.13 83.18 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.036 -175.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.895 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.5 mp -65.79 -39.59 85.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 171.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.6 mt -58.04 -48.19 84.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.988 -178.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -70.93 -36.4 72.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.517 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.12 -46.09 6.02 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.17 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 93' ' ' ILE . 48.7 m -72.73 -38.27 67.49 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 116.494 0.147 . . . . 0.0 110.919 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.55 -39.3 76.35 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.295 -0.253 . . . . 0.0 110.983 170.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -74.33 -43.01 58.48 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.144 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.1 m -94.57 14.55 20.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.708 -173.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.21 151.39 81.71 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.472 ' C ' ' H ' ' A' ' 104' ' ' ASN . 51.5 Cg_exo -56.63 163.26 7.23 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.924 2.416 . . . . 0.0 112.189 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.92 33.34 0.13 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.482 2.788 . . . . 0.0 113.168 177.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.472 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.4 m-20 -121.81 101.9 7.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -79.56 96.12 6.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.99 0.9 . . . . 0.0 109.546 178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -90.42 104.73 17.27 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.619 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -31.29 -77.26 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 O-C-N 124.824 1.328 . . . . 0.0 113.735 -169.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 42.2 t -95.91 -11.08 27.21 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.826 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 1.9 tmm? -86.89 -16.34 36.3 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 112.613 -169.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.562 ' HG3' ' H ' ' A' ' 111' ' ' THR . 22.5 pttt -55.59 -45.94 77.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.769 0.795 . . . . 0.0 111.068 -173.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.626 HG23 HD12 ' A' ' 112' ' ' ILE . 12.6 t -57.33 -13.73 3.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.426 -1.261 . . . . 0.0 112.843 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -90.45 -37.35 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -58.09 -37.03 73.73 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.687 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -79.42 -36.48 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.38 0.609 . . . . 0.0 110.447 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.19 70.64 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.373 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.698 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 19.5 ptt? -69.59 -17.89 63.58 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.201 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 53.0 t -73.26 -22.36 60.41 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.895 ' HB2' HG21 ' A' ' 93' ' ' ILE . 54.2 t80 -81.0 -46.3 15.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.686 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.29 -17.52 63.09 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 118.309 -1.356 . . . . 0.0 109.397 175.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.698 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.47 -55.3 21.67 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.149 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 8.0 mm-40 -58.95 -51.3 70.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.642 175.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.33 -32.9 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 178.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -70.9 -32.8 69.86 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.038 -0.413 . . . . 0.0 112.057 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -73.76 -34.37 64.68 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.441 0.638 . . . . 0.0 109.959 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 79.1 mt . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.936 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.401 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.4 Cg_endo . . . . . 0 CA--C 1.528 0.196 0 CA-C-O 120.526 0.136 . . . . 0.0 112.351 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.29 -66.47 0.39 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.044 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tp -75.36 -15.6 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 121.17 0.51 . . . . 0.0 111.517 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.401 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 73.7 mtp -76.84 -40.61 47.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -80.12 97.05 6.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.91 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -62.38 123.27 17.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.342 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.07 -36.41 77.29 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.286 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 m -60.29 -34.64 74.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -75.0 -32.76 61.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.019 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -67.92 -45.06 75.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.721 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -57.1 -86.5 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 169.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.81 37.91 44.41 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.492 -178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -61.45 -59.31 5.44 Favored 'General case' 0 C--N 1.335 -0.042 0 CA-C-O 121.227 0.536 . . . . 0.0 110.437 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.45 100.55 3.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.965 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.508 ' HG2' ' OH ' ' A' ' 34' ' ' TYR . 17.0 tpt -74.61 -22.3 59.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.759 -178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -53.89 -31.53 50.21 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.473 -175.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 26.3 mt-30 -87.42 -21.33 25.66 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.834 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 32.1 t -75.27 -36.17 61.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 170.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.77 ' HA ' HD23 ' A' ' 25' ' ' LEU . 29.7 tptp -58.27 -51.07 71.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.636 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.13 -47.79 48.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.91 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.519 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 5.8 mm-40 -69.7 -32.28 70.79 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 54' ' ' CYS . 1.5 mm? -90.6 -21.46 21.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 61.91 50.28 4.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.117 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -63.12 125.7 87.48 Favored Pre-proline 0 CA--C 1.52 -0.188 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.959 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.7 Cg_exo -64.68 150.6 87.92 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.696 1.597 . . . . 0.0 109.4 168.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -54.99 -33.82 62.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.909 0.385 . . . . 0.0 111.676 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -78.58 -29.84 46.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.004 -174.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.434 HG11 ' CB ' ' A' ' 47' ' ' LEU . 26.1 t -77.22 -49.44 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 121.101 -0.24 . . . . 0.0 111.303 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.5 p -60.43 -27.36 39.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 121.114 0.483 . . . . 0.0 109.811 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.91 -52.02 33.77 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.699 173.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -63.65 -33.29 75.29 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.321 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.1 tp -51.02 -55.46 17.36 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.722 170.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.508 ' OH ' ' HG2' ' A' ' 16' ' ' MET . 18.4 m-85 -68.51 12.15 0.14 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 176.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.56 123.33 16.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 119.859 1.208 . . . . 0.0 110.419 -173.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -72.26 -36.24 68.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.719 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.2 m-90 -92.9 101.82 14.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.245 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -76.37 78.17 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.186 0.517 . . . . 0.0 109.896 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.549 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 34.5 t70 -62.51 12.1 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.0 t0 53.81 43.05 31.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.227 0.921 . . . . 0.0 110.047 -174.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.549 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 13.1 p90 -86.7 175.02 8.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.981 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -95.59 125.63 48.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.463 ' HE1' HD11 ' A' ' 52' ' ' ILE . 42.6 ttm -68.45 103.65 1.71 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.058 0.456 . . . . 0.0 110.251 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.9 p -93.31 -39.47 10.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.842 -174.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -83.57 134.56 34.81 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.924 0.868 . . . . 0.0 111.025 -176.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 4.2 mpt_? -74.98 -30.14 61.09 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.11 -1.404 . . . . 0.0 110.149 -173.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.625 HD12 HD13 ' A' ' 25' ' ' LEU . 3.7 mm? -66.55 -15.23 63.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.796 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.505 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.74 -56.76 3.93 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.582 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.33 -47.29 3.61 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-N 114.933 -1.03 . . . . 0.0 114.58 165.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 20.8 m -66.28 -44.52 83.33 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 118.786 1.293 . . . . 0.0 110.28 -178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.18 -17.3 63.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.553 -175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 48' ' ' ALA . 71.4 mt -54.37 -37.76 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.083 0.468 . . . . 0.0 110.22 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -143.79 71.96 1.34 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.317 0.58 . . . . 0.0 109.725 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.481 ' HB2' HD21 ' A' ' 23' ' ' LEU . 23.1 p -104.52 -45.93 4.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.385 176.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.4 tp -62.37 -47.28 84.86 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.417 -176.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.84 -16.25 51.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.904 0.383 . . . . 0.0 110.772 -173.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.48 HG23 ' CG1' ' A' ' 61' ' ' VAL . 55.3 m -84.06 -36.93 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.587 174.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 15.6 mmmt -68.31 -25.0 64.9 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.246 -0.284 . . . . 0.0 111.273 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.3 mt -64.49 -66.09 0.59 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 121.098 -0.241 . . . . 0.0 110.934 176.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -176.76 121.83 0.14 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.515 0.198 . . . . 0.0 110.744 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 57' ' ' THR . 13.9 p -173.29 50.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.256 1.027 . . . . 0.0 110.267 -176.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.59 ' HA ' ' HB2' ' A' ' 69' ' ' HIS . 1.5 m -110.1 125.8 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 121.601 -0.687 . . . . 0.0 111.249 -173.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -76.78 -56.14 1.4 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.265 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 16.4 Cg_endo -98.34 -139.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.504 2.803 . . . . 0.0 112.851 -171.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.502 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 28.8 t70 -71.5 -1.5 13.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.512 -177.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.44 -65.57 0.5 Allowed Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.34 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p-10 -76.31 149.57 37.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.549 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 68.6 40.67 1.83 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.318 0.58 . . . . 0.0 111.176 174.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 62' ' ' VAL . 8.3 p80 -74.73 69.54 1.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.511 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -82.22 -50.71 8.69 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.91 -56.16 26.34 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.837 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.68 -27.75 66.68 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.38 -36.71 66.12 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.454 0.645 . . . . 0.0 110.722 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -78.65 -37.85 41.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.68 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 18.9 t70 -66.72 -32.49 73.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.464 173.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -57.69 -42.04 82.88 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.995 0.426 . . . . 0.0 110.126 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 -34.86 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.679 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 72.7 mtm -74.42 -26.49 60.11 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 4.8 ptpp? -93.03 -18.47 22.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.714 -0.795 . . . . 0.0 110.933 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.407 ' NE2' ' HD3' ' A' ' 79' ' ' LYS . 14.8 m170 -134.53 91.44 2.78 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 124.31 -74.52 0.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.705 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -91.74 132.61 36.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.867 0.365 . . . . 0.0 111.315 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.484 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -85.11 173.57 10.36 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -59.59 -34.45 72.75 Favored 'General case' 0 N--CA 1.418 -2.058 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -170.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.795 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 5.2 t -63.61 -31.42 72.59 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.362 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 46.1 mtt -82.5 -39.66 22.14 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -64.23 -37.32 87.07 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.556 177.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.453 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -75.69 -26.17 57.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.502 -175.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 85' ' ' THR . 54.2 mm-40 -80.14 -24.26 40.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.67 172.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 94' ' ' ILE . 42.0 tp -84.15 -46.38 11.97 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.085 -176.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.453 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.2 m -56.88 -36.76 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.869 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.58 -43.53 80.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.437 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.731 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.6 mp -69.11 -43.32 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.245 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.7 mt -55.65 -47.79 78.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.669 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -71.06 -35.16 71.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.698 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.15 -45.25 6.32 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.491 -173.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' A' ' 93' ' ' ILE . 60.1 m -72.65 -37.05 68.09 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.117 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.09 -39.32 93.81 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.282 0.492 . . . . 0.0 110.719 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.92 -34.15 77.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.08 0.467 . . . . 0.0 110.48 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 m -104.09 17.19 24.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.973 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.76 155.97 67.95 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.252 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.06 143.84 91.68 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.968 1.779 . . . . 0.0 110.473 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.55 72.28 0.43 Allowed 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.665 2.243 . . . . 0.0 112.908 -176.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -125.62 95.21 4.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.823 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -76.51 96.31 4.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.191 0.519 . . . . 0.0 111.321 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 1.074 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.2 t70 -143.92 120.34 10.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.756 174.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.566 ' HB2' ' NZ ' ' A' ' 107' ' ' LYS . 3.9 ttmp? -34.68 -60.84 0.42 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 178.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.418 ' O ' HD13 ' A' ' 112' ' ' ILE . 5.9 m -89.51 -10.13 47.42 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 1.074 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 1.3 tmm? -69.03 -42.97 75.65 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-O 122.214 1.007 . . . . 0.0 110.092 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.591 ' HG3' ' H ' ' A' ' 111' ' ' THR . 14.4 ptpt -64.92 -49.98 68.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.169 -1.378 . . . . 0.0 111.342 -172.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.591 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 11.6 t -57.98 -14.98 7.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.68 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.582 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.5 mp -91.66 -40.71 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 8.5 t70 -61.94 -34.91 76.96 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.078 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.662 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.1 m -81.53 -37.38 15.36 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.865 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.2 -51.78 68.1 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-O 120.817 0.341 . . . . 0.0 111.795 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.651 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.43 -26.02 64.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.015 179.635 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 32.3 t -68.52 -24.76 64.69 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.112 0.482 . . . . 0.0 109.837 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 93' ' ' ILE . 37.8 t80 -77.31 -49.73 14.37 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.845 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -23.65 61.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.824 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.92 -54.43 46.27 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 118.869 0.758 . . . . 0.0 109.367 167.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.442 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 6.8 tp10 -58.07 -50.4 73.6 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.87 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.85 -32.89 22.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 117.742 0.246 . . . . 0.0 111.161 177.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -71.29 -32.88 69.17 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -78.47 -31.26 47.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 0.0 109.862 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 91.4 mt . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.52 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.2 Cg_exo . . . . . 0 CA--C 1.528 0.191 0 N-CA-C 112.552 0.174 . . . . 0.0 112.552 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -50.03 -67.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 111.341 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.896 HD11 ' HB2' ' A' ' 82' ' ' ALA . 23.4 mm -76.17 -16.25 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 121.066 0.46 . . . . 0.0 111.326 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.446 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 5.2 tmm? -68.4 -43.62 76.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.517 ' HE3' ' OD1' ' A' ' 11' ' ' ASN . 41.9 tptt -80.73 85.54 6.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.356 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.465 ' OD1' ' HB2' ' A' ' 10' ' ' ASN . 3.0 p30 -62.65 125.55 24.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.218 -175.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.704 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.9 pt? -61.85 -30.2 70.69 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.506 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -61.6 -41.49 97.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.796 0.331 . . . . 0.0 110.855 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.465 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m120 -78.05 -18.9 55.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.13 176.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.603 ' ND2' ' HA ' ' A' ' 8' ' ' LEU . 96.9 m-20 -66.51 -52.18 48.73 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -57.21 -84.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.941 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.54 34.79 35.7 Favored Glycine 0 C--N 1.344 0.989 0 C-N-CA 121.356 -0.45 . . . . 0.0 114.111 178.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.97 -56.27 23.75 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 117.272 0.536 . . . . 0.0 111.163 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -144.64 107.31 4.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.886 0.374 . . . . 0.0 110.879 -177.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.7 mtm -70.18 -32.5 70.47 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.747 0.308 . . . . 0.0 110.818 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.7 -22.8 67.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.915 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.638 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 3.2 pt20 -83.94 -27.02 28.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.077 -176.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.8 t -75.47 -35.64 60.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 173.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.32 -48.28 80.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.043 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.75 -44.13 43.21 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.276 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -63.3 -41.82 99.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.452 0.168 . . . . 0.0 111.262 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' HD22 ' A' ' 25' ' ' LEU . 3.4 mm? -79.21 -22.82 44.34 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.8 m 60.83 50.02 5.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.301 -175.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.6 mm? -61.29 131.08 92.14 Favored Pre-proline 0 N--CA 1.461 0.122 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 5.8 Cg_exo -73.69 154.24 49.17 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.144 1.896 . . . . 0.0 110.441 168.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.587 ' HA ' HG22 ' A' ' 30' ' ' VAL . 0.9 OUTLIER -65.98 -26.98 67.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.018 0.437 . . . . 0.0 110.801 -176.077 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -63.37 -40.67 97.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.279 0.561 . . . . 0.0 110.073 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.519 HG11 ' HB2' ' A' ' 47' ' ' LEU . 24.4 t -77.22 -43.8 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.342 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.7 m -56.02 -37.24 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 121.157 0.503 . . . . 0.0 109.997 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.19 -51.91 58.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.672 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.63 -37.1 86.41 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.163 0.506 . . . . 0.0 110.524 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -43.48 95.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.02 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.0 9.68 2.81 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -65.93 131.56 46.55 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.048 0.84 . . . . 0.0 110.666 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -91.1 -7.72 50.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.994 0.425 . . . . 0.0 110.903 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 6.9 m-90 -91.15 102.38 15.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.687 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -90.52 65.46 6.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -62.77 12.58 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.2 t0 54.54 71.52 0.52 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.559 1.072 . . . . 0.0 109.75 -169.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -115.34 157.12 24.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.245 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 67.1 t -86.2 116.15 28.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 48' ' ' ALA . 55.3 tpp -71.26 103.71 2.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.566 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -99.94 -9.13 23.13 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -90.39 127.78 36.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 109.718 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.606 ' N ' ' HD3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -78.48 -19.59 52.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.288 -170.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -75.76 -19.37 59.07 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.228 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HB3' ' SD ' ' A' ' 43' ' ' MET . . . -85.29 -59.07 2.43 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.42 -47.68 2.86 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-N 115.176 -0.92 . . . . 0.0 114.083 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 m -65.4 -45.49 83.78 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 118.207 1.003 . . . . 0.0 111.619 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.14 -3.06 24.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.0 mm -59.73 -35.78 61.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -145.2 82.65 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 173.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 21.4 p -108.79 -45.53 3.8 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.889 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.488 HD11 ' H ' ' A' ' 15' ' ' ALA . 6.7 tt -63.99 -44.43 92.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.932 -174.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.63 55.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.037 0.446 . . . . 0.0 110.371 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.47 HG23 HG11 ' A' ' 61' ' ' VAL . 43.6 m -80.9 -32.0 34.96 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.581 175.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 19.2 mmmt -82.04 -16.75 49.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.846 177.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.2 mt -66.71 -67.17 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 171.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -178.1 127.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.47 HG11 HG23 ' A' ' 57' ' ' THR . 9.3 p -172.56 32.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 122.109 0.957 . . . . 0.0 109.778 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.0 m -102.79 120.95 53.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 O-C-N 121.769 -0.582 . . . . 0.0 111.605 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.3 -56.78 5.06 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.427 174.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 17.8 Cg_endo -100.74 -140.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.355 2.703 . . . . 0.0 113.271 -170.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.514 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 24.1 m-20 -75.3 5.49 5.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.58 -175.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 139.75 -75.46 0.36 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -177.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.757 HD22 HD23 ' A' ' 68' ' ' LEU . 2.0 p-10 -69.07 156.77 38.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.827 -0.686 . . . . 0.0 110.901 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.757 HD23 HD22 ' A' ' 67' ' ' ASN . 4.0 mm? 70.05 29.21 3.91 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.266 0.626 . . . . 0.0 112.533 174.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.594 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.6 p-80 -78.08 67.57 3.95 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.254 0.549 . . . . 0.0 111.284 174.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.452 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 9.0 p80 -86.61 -45.74 10.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.837 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.96 -55.36 30.77 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.317 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -59.94 -28.39 67.58 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.705 -0.248 . . . . 0.0 111.488 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.62 -34.98 74.83 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.345 0.593 . . . . 0.0 110.983 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 70.5 mmtt -78.56 -37.32 43.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 109.241 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.77 -40.01 94.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.637 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -62.59 -34.06 76.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.073 177.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.08 -32.08 69.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.994 177.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 89.1 mtp -70.67 -35.14 72.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.778 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -90.28 -14.83 32.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.478 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.456 ' O ' HD13 ' A' ' 8' ' ' LEU . 70.3 m-70 -140.05 92.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.361 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.29 -73.59 0.46 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.876 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.896 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.39 145.26 30.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.959 0.409 . . . . 0.0 111.248 -175.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -87.78 177.13 7.09 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.027 175.205 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -40.45 65.56 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.38 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.727 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 13.0 t -72.12 -33.55 67.9 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.119 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.483 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 68.6 mtp -81.4 -39.15 25.43 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 121.96 -0.463 . . . . 0.0 109.886 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -60.22 -37.92 81.78 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 173.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.438 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.36 -24.93 60.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.685 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.727 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.2 mm-40 -79.87 -25.92 40.5 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.404 -0.518 . . . . 0.0 109.898 173.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 22.7 tp -87.62 -44.2 11.4 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.954 -174.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 87' ' ' ALA . 14.5 m -57.24 -36.03 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.179 -176.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.41 -44.18 95.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.952 0.406 . . . . 0.0 110.181 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.449 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -68.32 -42.38 84.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.234 175.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 57.8 mt -54.87 -49.2 72.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.307 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -70.77 -35.12 72.45 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.487 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.4 -56.39 2.84 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.26 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 21.7 m -72.73 -29.73 63.59 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.17 -34.17 76.97 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.631 0.651 . . . . 0.0 110.108 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -70.39 -42.96 71.02 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.832 0.349 . . . . 0.0 111.137 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -94.08 10.37 33.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.763 0.316 . . . . 0.0 111.688 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB1' ' HD2' ' A' ' 102' ' ' PRO . . . -64.53 156.3 77.93 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.445 ' HD2' ' HB1' ' A' ' 101' ' ' ALA . 9.8 Cg_endo -50.87 156.4 4.74 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.251 2.634 . . . . 0.0 112.464 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.7 Cg_exo -68.68 24.48 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.555 2.837 . . . . 0.0 113.496 -175.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 102' ' ' PRO . 17.0 m120 -110.79 105.12 13.86 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.54 84.95 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.159 0.504 . . . . 0.0 109.944 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.8 t70 -101.17 103.94 15.0 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.563 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -37.58 -50.39 1.14 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 114.317 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.556 ' O ' HG22 ' A' ' 111' ' ' THR . 5.4 t -95.26 -20.93 18.78 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.037 0.835 . . . . 0.0 113.189 -176.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.736 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 56.2 mmm -74.55 -29.07 61.22 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.026 0.83 . . . . 0.0 112.334 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 111' ' ' THR . 27.5 pttt -56.34 -45.45 80.39 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.492 -172.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 108' ' ' CYS . 14.6 t -57.61 -16.36 10.13 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.711 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.538 ' O ' ' HG3' ' A' ' 116' ' ' MET . 3.1 mp -90.07 -37.2 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.43 -37.98 79.5 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.865 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.95 -37.45 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.55 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.01 -52.67 64.01 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.538 ' HG3' ' O ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -69.72 -19.73 63.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.396 178.681 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.588 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 5.0 t -71.58 -30.62 66.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.493 173.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.417 ' HA ' HG12 ' A' ' 93' ' ' ILE . 86.7 t80 -76.78 -45.95 26.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.794 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' HG22 ' A' ' 122' ' ' ILE . 3.3 pttp -70.32 -30.0 66.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.357 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.588 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -66.69 -44.44 81.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.179 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 23.9 mm-40 -59.01 -53.54 57.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.172 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.524 ' HA ' HD12 ' A' ' 125' ' ' LEU . 8.5 tt -55.74 -32.93 32.74 Favored 'Isoleucine or valine' 0 C--N 1.345 0.4 0 CA-C-N 118.023 0.374 . . . . 0.0 111.401 -178.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 7.2 m170 -71.3 -33.37 69.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.2 ttpt -76.59 -15.58 59.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.238 0.542 . . . . 0.0 110.7 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 87.0 mt . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.601 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.647 ' O ' ' HG2' ' A' ' 6' ' ' LYS . 36.2 Cg_exo . . . . . 0 N--CA 1.473 0.267 0 N-CA-C 113.578 0.568 . . . . 0.0 113.578 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -45.02 -69.52 0.13 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.544 0.527 . . . . 0.0 112.133 -176.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.606 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -87.2 -9.09 11.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.415 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 75.4 mtp -74.93 -25.6 59.01 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -177.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 2' ' ' PRO . 21.3 pttp -97.03 89.26 4.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.449 0.642 . . . . 0.0 109.721 173.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.02 125.18 24.09 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.003 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -59.32 -33.85 71.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.781 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -61.86 -38.07 86.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.164 0.507 . . . . 0.0 110.082 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -75.39 -30.91 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.302 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.24 -55.99 10.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.296 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -47.78 -74.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.034 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . 0.621 ' HA2' ' HG3' ' A' ' 16' ' ' MET . . . 54.65 33.48 55.03 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.219 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -68.38 -43.05 78.21 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.506 0.653 . . . . 0.0 110.189 178.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.12 66.78 1.31 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.172 0.51 . . . . 0.0 110.905 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.621 ' HG3' ' HA2' ' A' ' 13' ' ' GLY . 73.4 mtm -70.35 -25.01 63.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.78 -31.86 62.98 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.663 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 23.9 mt-30 -87.97 -25.37 23.2 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.059 -0.656 . . . . 0.0 111.091 -172.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -71.46 -35.33 70.84 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.937 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.31 -52.62 62.93 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.114 -178.063 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.03 -36.95 67.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.53 -175.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 15.6 tt0 -68.63 -42.27 78.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.727 0.299 . . . . 0.0 111.201 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.749 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 18.0 mt -84.2 -1.08 54.52 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.822 0.344 . . . . 0.0 110.664 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 63.69 36.59 10.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.304 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.937 ' HB2' ' HD3' ' A' ' 20' ' ' LYS . 1.2 mm? -49.41 119.16 8.87 Favored Pre-proline 0 N--CA 1.471 0.59 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.73 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.564 ' HD2' ' CD2' ' A' ' 47' ' ' LEU . 12.7 Cg_exo -73.93 154.17 47.87 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.416 2.077 . . . . 0.0 109.861 167.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -55.79 -32.9 63.91 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -66.03 -53.02 43.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.855 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.579 ' CB ' HD23 ' A' ' 47' ' ' LEU . 36.0 t -70.35 -50.68 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.718 -176.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.518 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 8.8 p -59.7 -33.4 51.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.152 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.93 -51.17 58.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.556 177.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.92 -32.58 73.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.064 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.6 tp -48.44 -55.38 11.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.081 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.92 13.39 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.466 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 52.0 t30 -53.86 122.31 9.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 119.521 1.055 . . . . 0.0 111.803 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -71.79 -33.15 68.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.917 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 31.0 m-90 -79.04 145.41 33.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.14 0.495 . . . . 0.0 110.965 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.57 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.65 54.28 2.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.462 -173.516 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.508 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 27.7 t70 -43.52 -42.59 5.03 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.9 t70 63.08 70.44 0.54 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 118.861 0.755 . . . . 0.0 109.853 -175.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.508 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 1.5 p90 -106.3 175.5 5.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.8 -175.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 93.6 t -84.1 125.14 40.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.754 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttp -77.71 96.03 4.77 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.214 0.531 . . . . 0.0 110.226 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -103.42 -39.11 6.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.755 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.408 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 10.2 t70 -69.42 124.85 24.96 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.74 0.781 . . . . 0.0 110.07 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.561 ' HG2' ' HG2' ' A' ' 109' ' ' MET . 2.5 mpt_? -79.89 -28.06 39.92 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.717 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.737 HD11 HD22 ' A' ' 25' ' ' LEU . 7.4 tp -69.61 -19.06 63.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.948 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.57 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -78.37 -60.61 2.3 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.91 -46.78 1.78 Allowed Glycine 0 CA--C 1.534 1.227 0 CA-C-N 114.399 -1.273 . . . . 0.0 114.654 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 74.2 m -66.85 -43.61 83.2 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.522 1.161 . . . . 0.0 110.619 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.5 -22.07 66.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.761 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 48' ' ' ALA . 47.8 mm -61.83 -36.23 72.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-O 120.903 0.382 . . . . 0.0 111.127 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -122.2 76.88 1.34 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.557 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.7 p -125.19 -47.29 1.76 Allowed 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.301 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.9 tt -63.53 -65.51 0.67 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 111.786 -168.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.15 -12.47 59.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.252 0.548 . . . . 0.0 110.016 -174.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.538 ' HA ' HG11 ' A' ' 61' ' ' VAL . 56.3 m -83.9 -33.05 24.83 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.726 176.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 8.1 mmmt -75.35 -23.44 57.2 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.363 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.5 mt -63.79 -66.28 0.56 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.571 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -177.4 123.96 0.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.588 HG23 ' CD2' ' A' ' 76' ' ' PHE . 10.4 p -178.67 34.57 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.99 0.9 . . . . 0.0 110.139 -174.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.716 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 28.1 m -98.82 114.02 35.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.802 0.811 . . . . 0.0 112.227 -170.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.23 -56.31 10.99 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.954 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.565 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 13.6 Cg_endo -97.91 -138.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 123.311 2.674 . . . . 0.0 113.254 -170.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.2 m-20 -72.24 2.39 6.06 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.622 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.19 -75.92 0.3 Allowed Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.8 p-10 -75.17 170.91 15.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.803 -0.699 . . . . 0.0 110.317 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 69.66 29.79 4.11 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.519 0.512 . . . . 0.0 111.621 173.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.716 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 3.5 p80 -73.11 79.89 1.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.392 0.615 . . . . 0.0 110.984 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.435 ' H ' ' CD2' ' A' ' 70' ' ' HIS . 5.6 p80 -85.1 -58.85 2.52 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.651 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.0 -61.49 6.37 Favored Glycine 0 N--CA 1.443 -0.867 0 C-N-CA 121.154 -0.545 . . . . 0.0 113.171 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -54.1 -36.02 62.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -71.55 -37.89 71.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.204 0.525 . . . . 0.0 111.337 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.461 ' NZ ' HG21 ' A' ' 94' ' ' ILE . 92.2 mttt -81.37 -30.45 33.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.002 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.13 -41.64 94.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.144 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.588 ' CD2' HG23 ' A' ' 61' ' ' VAL . 2.5 m-85 -62.57 -36.65 83.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.857 176.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.9 -40.27 75.73 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.639 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.629 ' HB3' ' CB ' ' A' ' 87' ' ' ALA . 1.7 ptt? -76.92 -14.87 59.82 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.645 ' HG3' ' HD2' ' A' ' 80' ' ' HIS . 18.5 ptpt -90.88 -18.61 24.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.126 173.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.645 ' HD2' ' HG3' ' A' ' 79' ' ' LYS . 12.3 p80 -149.77 99.49 2.86 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.683 0.278 . . . . 0.0 111.565 172.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.18 -75.97 0.41 Allowed Glycine 0 C--O 1.234 0.123 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.099 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.606 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -89.22 149.94 22.88 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.651 ' OD2' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -88.7 167.4 13.36 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -72.56 -23.31 60.96 Favored 'General case' 0 N--CA 1.421 -1.907 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.716 -166.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.651 ' HB ' ' OD2' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -73.29 -34.35 65.71 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.338 176.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.474 ' HA ' HE21 ' A' ' 89' ' ' GLN . 3.3 tpt -77.27 -43.52 33.02 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.111 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.629 ' CB ' ' HB3' ' A' ' 78' ' ' MET . . . -65.24 -41.59 94.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.353 175.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -69.23 -26.25 64.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -175.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.474 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.7 pt20 -82.78 -28.9 29.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.844 175.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -76.93 -46.73 23.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 87' ' ' ALA . 25.4 m -57.69 -35.9 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.892 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.21 -44.51 88.06 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.924 0.392 . . . . 0.0 110.567 -176.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.582 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.2 mp -60.21 -42.66 91.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.455 174.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.506 ' HA ' ' HB ' ' A' ' 114' ' ' VAL . 59.6 mt -55.25 -47.17 78.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.312 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -67.07 -31.45 71.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.429 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 99' ' ' LYS . . . -80.97 -50.67 5.08 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.374 -173.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 13.8 m -73.61 -32.75 64.24 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.171 -0.612 . . . . 0.0 112.21 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 94' ' ' ILE . 8.7 tp10 -57.89 -38.48 75.87 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.434 0.561 . . . . 0.0 110.416 168.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 96' ' ' GLY . 31.8 ttpt -63.48 -40.85 98.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.592 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.8 m -102.11 24.41 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.305 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.69 152.92 49.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 55.7 Cg_endo -69.87 162.19 43.08 Favored 'Trans proline' 0 CA--C 1.529 0.249 0 C-N-CA 122.578 2.186 . . . . 0.0 112.275 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 17.0 Cg_exo -69.2 59.01 1.33 Allowed 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.402 2.735 . . . . 0.0 112.587 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -103.93 113.28 26.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.504 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -79.0 16.31 0.94 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.811 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.1 t70 -90.85 112.18 23.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.093 0.473 . . . . 0.0 110.581 -176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.63 ' HE3' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.47 -54.25 3.17 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.557 ' O ' HD13 ' A' ' 112' ' ' ILE . 68.4 m -83.33 -21.91 33.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.371 0.987 . . . . 0.0 112.187 -176.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.811 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 5.7 mmm -63.33 -44.54 94.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.161 0.505 . . . . 0.0 110.57 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.634 ' HA ' ' OD2' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -66.17 -49.26 67.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.058 -177.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.448 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.64 -13.83 4.53 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.98 175.183 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.2 mp -91.06 -41.56 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 O-C-N 121.933 -0.479 . . . . 0.0 110.03 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.634 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 3.2 p30 -63.08 -34.15 76.97 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.494 177.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 18.8 m -80.09 -36.31 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.49 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.53 -50.5 72.42 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 121.701 0.763 . . . . 0.0 111.339 176.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.756 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.3 ptt? -68.72 -17.75 64.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.784 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 25.8 t -71.92 -30.55 65.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.601 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.582 ' HB2' HG21 ' A' ' 93' ' ' ILE . 85.4 t80 -72.04 -44.91 62.6 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.776 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.429 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.68 -29.25 66.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 118.139 -1.424 . . . . 0.0 111.276 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.756 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.61 -56.21 19.15 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.756 170.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.53 -51.04 71.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.409 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -32.79 41.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 118.22 0.464 . . . . 0.0 111.287 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -71.98 -31.9 66.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.455 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -79.05 -36.19 41.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.332 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.624 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 2.6 Cg_exo . . . . . 0 CA--C 1.534 0.494 0 N-CA-C 114.921 1.085 . . . . 0.0 114.921 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -49.06 -70.57 0.09 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.607 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.9 tp -86.31 -9.47 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 121.124 0.488 . . . . 0.0 111.467 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.624 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 85.3 mtp -77.71 -30.6 51.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.959 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.638 ' HE2' HD21 ' A' ' 11' ' ' ASN . 82.2 tttt -84.7 94.37 8.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.219 0.533 . . . . 0.0 109.838 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -71.94 115.6 11.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.182 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 8' ' ' LEU . 5.8 mp -58.48 -37.73 76.14 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.342 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.548 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 6.1 p -65.08 -28.74 69.67 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.96 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.98 -26.51 56.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.894 175.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.638 HD21 ' HE2' ' A' ' 6' ' ' LYS . 5.1 m-20 -66.82 -45.66 77.59 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.548 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 67.9 m-85 -55.23 -84.37 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.381 171.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.02 36.79 15.33 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.688 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -66.34 -37.62 85.75 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.812 0.339 . . . . 0.0 111.012 -177.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.14 92.23 2.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.071 0.462 . . . . 0.0 109.85 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttp -71.32 -33.08 69.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.0 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.0 -29.3 65.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.064 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -88.52 -21.23 24.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.876 -172.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.9 t -74.85 -36.17 62.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -63.49 -45.56 90.17 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.384 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.84 -47.63 58.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.87 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.9 tp10 -67.96 -40.69 83.15 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.45 ' HB2' HD22 ' A' ' 25' ' ' LEU . 2.2 mm? -77.81 -21.52 51.43 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 61.67 48.16 5.83 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.843 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.875 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -61.29 128.34 89.52 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.359 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.4 Cg_exo -66.46 149.85 84.42 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.812 1.675 . . . . 0.0 109.694 170.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -61.06 -31.65 71.3 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 121.152 -0.219 . . . . 0.0 110.975 -175.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.4 m -66.46 -46.39 76.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.875 0.369 . . . . 0.0 110.801 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 47' ' ' LEU . 38.3 t -71.38 -52.73 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.626 -176.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 5.0 p -60.2 -34.97 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.871 -175.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.36 -51.52 59.88 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.94 0.4 . . . . 0.0 111.267 177.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.68 -37.46 76.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.578 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.542 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 1.6 pp -59.81 -30.64 69.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.536 177.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -62.86 9.8 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 174.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -56.03 110.18 0.7 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 120.474 1.488 . . . . 0.0 111.367 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -76.48 -14.96 60.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.059 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -88.2 157.95 18.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -87.07 53.6 2.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.779 0.8 . . . . 0.0 109.959 175.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.579 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 10.6 t70 -42.78 -45.5 4.84 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.818 177.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 63.04 70.47 0.55 Allowed 'General case' 0 C--N 1.347 0.481 0 CA-C-O 121.639 0.733 . . . . 0.0 109.85 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 14.9 p90 -109.76 164.05 12.93 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.305 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 38.2 t -84.17 113.91 23.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.417 ' HB3' HG21 ' A' ' 112' ' ' ILE . 38.6 ttm -70.99 104.32 2.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.17 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -108.22 -18.43 13.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.392 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.15 139.68 30.39 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.94 0.876 . . . . 0.0 111.382 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.556 ' HA ' ' HG2' ' A' ' 109' ' ' MET . 6.7 mpt_? -70.72 -32.65 69.91 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.898 -1.501 . . . . 0.0 110.608 -171.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.643 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.3 mm? -73.62 -15.07 61.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.968 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.64 -61.03 2.09 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.618 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.11 -48.01 3.48 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.079 -0.964 . . . . 0.0 114.586 168.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 m -66.15 -42.66 88.72 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.495 1.148 . . . . 0.0 111.56 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.94 -23.14 67.25 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.2 mm -55.79 -38.35 51.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.053 0.454 . . . . 0.0 110.329 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -131.27 81.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.214 1.007 . . . . 0.0 110.142 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.5 t -114.58 -47.19 2.92 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.706 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.468 ' O ' HD23 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.33 -68.02 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.016 0.436 . . . . 0.0 111.195 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.55 -10.46 59.45 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.087 0.47 . . . . 0.0 110.612 -172.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.956 HG23 HG11 ' A' ' 61' ' ' VAL . 51.7 m -78.8 -35.8 43.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 174.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . 3.1 mtpt -80.64 -17.31 51.65 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.514 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.468 HD23 ' O ' ' A' ' 55' ' ' LEU . 3.8 mm? -63.93 -60.16 3.61 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.127 170.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -176.02 116.86 0.13 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.603 0.24 . . . . 0.0 110.848 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.956 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -155.0 31.37 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.515 0.674 . . . . 0.0 110.501 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.668 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.4 m -107.84 121.65 61.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 O-C-N 121.761 -0.587 . . . . 0.0 111.901 -174.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -76.2 -57.49 1.39 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.218 174.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.76 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 65.9 Cg_endo -104.18 -138.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.768 2.979 . . . . 0.0 113.596 -167.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.8 m-20 -72.2 12.01 0.5 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.895 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.56 -74.59 0.39 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -70.28 153.12 43.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.249 -0.475 . . . . 0.0 110.386 176.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.58 36.69 2.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.384 0.611 . . . . 0.0 110.645 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.76 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 8.5 p80 -72.37 79.88 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.535 0.683 . . . . 0.0 111.045 175.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -86.94 -60.38 2.0 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.085 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.78 -62.26 6.3 Favored Glycine 0 CA--C 1.507 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 113.115 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -59.14 -23.54 62.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.09 64.95 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.272 0.558 . . . . 0.0 110.769 178.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.747 ' HE2' HG12 ' A' ' 91' ' ' VAL . 32.0 mmmt -80.3 -32.5 38.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.823 177.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.48 -39.9 94.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.685 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -63.49 -42.81 98.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.628 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.04 -37.78 72.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.611 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.1 mtm -69.92 -32.13 70.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.601 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 16.9 tptm -93.25 -10.32 36.01 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.822 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.512 ' HB3' HD22 ' A' ' 8' ' ' LEU . 75.7 m-70 -141.96 89.74 2.21 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 122.076 -0.39 . . . . 0.0 110.85 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' A' ' 8' ' ' LEU . . . 127.35 -68.17 0.54 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.793 174.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.607 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -106.34 140.85 38.62 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.851 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.37 159.65 29.35 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -61.6 -49.83 75.03 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.744 -164.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 7.0 t -60.14 -28.7 68.11 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.959 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.7 tpt -79.86 -46.24 17.21 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.48 0.657 . . . . 0.0 109.735 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.65 -35.78 70.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.805 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.12 -25.17 60.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.594 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.0 mm-40 -75.65 -23.54 56.3 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 172.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.65 ' O ' HG13 ' A' ' 94' ' ' ILE . 36.3 tp -84.98 -41.98 15.35 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.255 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.747 HG12 ' HE2' ' A' ' 74' ' ' LYS . 35.1 m -57.6 -35.81 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -66.22 -44.12 84.73 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.232 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.821 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.4 mp -62.11 -44.18 98.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.606 173.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.65 HG13 ' O ' ' A' ' 90' ' ' LEU . 39.2 mt -51.89 -47.06 41.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-O 120.716 0.293 . . . . 0.0 110.526 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.53 -36.6 73.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.923 0.392 . . . . 0.0 110.641 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.59 -42.32 7.87 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 119.979 -1.105 . . . . 0.0 112.004 -173.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.629 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.2 m -73.23 -41.44 63.73 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HG2' HG11 ' A' ' 114' ' ' VAL . 24.1 mm-40 -56.68 -38.73 72.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.45 171.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -69.68 -42.73 73.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.755 0.312 . . . . 0.0 111.661 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.0 m -96.86 8.01 45.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.37 149.83 94.11 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.04 164.85 4.48 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.111 2.541 . . . . 0.0 112.265 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 38.63 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.437 2.758 . . . . 0.0 113.212 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.45 104.98 16.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.718 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.83 87.05 4.71 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.4 t0 -112.05 104.23 12.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.279 -174.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -35.69 -76.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 124.595 1.184 . . . . 0.0 113.787 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.1 t -94.99 -15.59 23.41 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.556 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 1.9 mmm -86.02 -22.99 26.98 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -168.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.716 ' HD3' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.57 -38.6 81.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 122.069 0.938 . . . . 0.0 110.076 -175.367 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.919 HG22 HD12 ' A' ' 112' ' ' ILE . 0.6 OUTLIER -56.27 -16.86 6.1 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.101 -1.409 . . . . 0.0 112.291 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.919 HD12 HG22 ' A' ' 111' ' ' THR . 1.8 mp -91.17 -36.74 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -58.72 -37.1 75.42 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.199 176.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.616 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 4.8 m -80.71 -32.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.656 0.741 . . . . 0.0 109.971 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.57 -48.93 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.746 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.0 ptt? -69.18 -13.65 62.53 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.366 177.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.93 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 52.5 t -73.64 -31.75 63.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.758 173.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.821 ' HB2' HG21 ' A' ' 93' ' ' ILE . 74.2 t80 -74.17 -47.1 38.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.173 177.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.467 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.45 -23.99 63.74 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 118.492 -1.283 . . . . 0.0 110.163 -178.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.93 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 25.0 ttpt -56.73 -54.09 50.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.017 0.437 . . . . 0.0 110.314 166.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -58.73 -48.81 79.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.539 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.467 HG22 ' HA ' ' A' ' 119' ' ' LYS . 10.7 tt -58.44 -30.13 40.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 CA-C-N 118.361 0.528 . . . . 0.0 110.762 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -71.28 -32.52 68.77 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.82 -33.72 74.3 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.433 0.635 . . . . 0.0 109.783 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.516 175.665 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.577 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 36.9 Cg_exo . . . . . 0 N--CA 1.471 0.204 0 N-CA-C 112.761 0.254 . . . . 0.0 112.761 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -50.79 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.851 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.2 tt -83.16 -9.85 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.345 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.577 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.1 ttt -66.32 -28.66 68.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.244 0.545 . . . . 0.0 109.887 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -83.6 100.24 10.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.754 172.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.567 ' HB2' HD22 ' A' ' 10' ' ' ASN . 17.5 m120 -61.8 137.8 58.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.524 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.2 mt -54.18 -34.53 60.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.201 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.6 p -62.16 -40.75 97.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.277 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.567 HD22 ' HB2' ' A' ' 7' ' ' ASN . 56.9 m-80 -77.12 -30.45 55.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -68.21 -55.34 12.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -57.56 -82.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 170.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.19 36.35 35.93 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.804 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -69.37 -49.62 53.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.198 0.499 . . . . 0.0 110.383 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -153.8 105.39 2.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.488 178.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 54.7 ttp -75.47 -21.78 57.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.254 0.55 . . . . 0.0 110.194 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -63.03 -23.91 67.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.716 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.683 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 21.0 pt20 -84.56 -25.69 28.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.335 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.0 m -75.25 -35.45 61.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.513 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.09 -49.5 74.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.209 -178.096 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -70.62 -43.09 69.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.424 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.683 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.5 tm-20 -62.0 -44.29 97.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.966 -175.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.448 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 15.2 mt -81.98 -13.65 57.14 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.637 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.0 m 57.64 38.36 27.69 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.091 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.605 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 19.2 mt -51.01 120.94 14.66 Favored Pre-proline 0 N--CA 1.465 0.325 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.093 -174.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.3 Cg_exo -69.05 154.46 70.53 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.165 1.91 . . . . 0.0 111.036 174.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.637 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.3 p-10 -65.63 -27.34 68.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.678 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -64.64 -40.52 95.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 109.566 174.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.3 t -72.85 -50.1 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.234 -177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.8 m -54.98 -30.75 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 120.876 0.369 . . . . 0.0 110.21 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.21 -51.53 63.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.554 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -70.62 -39.22 73.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.453 0.644 . . . . 0.0 109.748 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 2.7 tm? -51.25 -54.35 26.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.576 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.24 9.66 0.07 Allowed 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -66.67 104.27 1.26 Allowed 'General case' 0 C--N 1.345 0.404 0 CA-C-N 120.332 1.423 . . . . 0.0 109.483 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -86.49 -20.16 28.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.512 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -90.27 142.32 27.84 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.439 0.638 . . . . 0.0 110.894 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.665 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -80.64 65.73 5.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.092 -171.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -62.39 -27.4 69.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.656 170.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.5 t70 63.09 70.66 0.54 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.593 0.711 . . . . 0.0 109.563 -172.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.4 p90 -95.63 163.15 13.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.082 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.8 t -87.97 121.64 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.552 ' O ' HG21 ' A' ' 112' ' ' ILE . 43.4 tpp -76.45 104.68 7.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.474 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 p -110.13 -4.79 15.59 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.76 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -96.4 131.45 42.94 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 110.443 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.477 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 8.8 mpt_? -73.02 -23.9 60.67 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.87 -171.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.605 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.8 mm? -78.16 -18.12 55.95 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.055 0.455 . . . . 0.0 109.928 -177.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -85.16 -55.81 3.86 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -175.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.44 -48.32 2.94 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.939 165.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.7 m -64.12 -42.02 97.01 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.143 0.971 . . . . 0.0 111.667 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.539 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.1 mm -63.77 -29.74 48.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.963 0.411 . . . . 0.0 111.34 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -135.8 44.49 2.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.933 0.397 . . . . 0.0 111.362 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.552 ' SG ' HD12 ' A' ' 55' ' ' LEU . 24.6 p -94.27 -36.15 12.12 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.552 HD12 ' SG ' ' A' ' 54' ' ' CYS . 8.6 mp -56.41 -69.67 0.14 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -170.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.477 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.75 -8.8 59.73 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.061 0.458 . . . . 0.0 110.777 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.609 ' HA ' HG11 ' A' ' 61' ' ' VAL . 55.8 m -80.47 -35.16 35.23 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.297 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HE2' ' HG3' ' A' ' 22' ' ' GLU . 16.9 mmmt -77.64 -21.84 51.63 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.4 173.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.9 mt -65.05 -65.84 0.62 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.814 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.16 119.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.609 HG11 ' HA ' ' A' ' 57' ' ' THR . 10.6 p -178.4 34.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.613 0.72 . . . . 0.0 111.13 -177.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.68 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.7 m -102.24 118.78 49.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.953 -1.092 . . . . 0.0 111.256 -173.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.16 -56.01 14.33 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.265 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.611 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 8.7 Cg_endo -95.01 -139.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.009 2.473 . . . . 0.0 112.854 -171.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.45 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 3.8 m-20 -76.27 11.18 1.63 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.587 -176.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.8 -75.41 0.4 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.523 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.648 HD22 HD23 ' A' ' 68' ' ' LEU . 1.9 p-10 -75.33 159.3 31.62 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.03 -0.585 . . . . 0.0 111.158 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.648 HD23 HD22 ' A' ' 67' ' ' ASN . 4.6 mm? 68.95 43.24 1.18 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.255 0.55 . . . . 0.0 111.967 174.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.68 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 6.7 p80 -83.34 76.0 9.94 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.476 0.655 . . . . 0.0 110.693 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -86.86 -61.93 1.62 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.814 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.15 -52.8 51.2 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.619 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -56.94 -34.68 68.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.286 . . . . 0.0 111.579 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.12 -36.15 74.6 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.184 0.516 . . . . 0.0 111.224 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 74' ' ' LYS . 21.1 mmmt -79.82 -35.18 38.78 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 33.3 t70 -64.18 -35.44 80.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.648 173.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.508 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 52.0 t80 -62.26 -35.27 78.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.485 176.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.21 72.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.856 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -68.2 -39.05 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.639 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.65 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 34.3 pttt -93.29 -5.95 48.58 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.227 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.65 ' CD2' ' HG3' ' A' ' 79' ' ' LYS . 66.6 m-70 -136.06 88.9 2.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.629 0.252 . . . . 0.0 110.75 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.22 -75.09 0.36 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.802 172.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -99.56 132.59 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.896 0.379 . . . . 0.0 111.331 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.481 ' OD2' HG22 ' A' ' 85' ' ' THR . 6.5 p-10 -79.21 172.36 13.91 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.62 -45.68 77.48 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -164.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.743 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 11.3 t -53.66 -40.69 66.1 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 58.9 mtm -82.24 -38.22 24.81 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.111 0.482 . . . . 0.0 109.701 -174.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.67 -37.58 76.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.165 172.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.76 -24.93 59.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.997 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.743 ' HG2' ' O ' ' A' ' 85' ' ' THR . 66.0 mm-40 -77.88 -23.49 48.77 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 64.1 tp -88.3 -48.26 7.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.293 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 88' ' ' GLN . 17.1 m -57.22 -38.13 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -172.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -68.14 -43.38 78.45 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.389 0.614 . . . . 0.0 110.363 -175.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.702 HG23 ' HB2' ' A' ' 117' ' ' CYS . 1.7 mp -61.8 -43.01 96.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.713 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.6 mt -55.64 -47.05 79.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.223 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -65.67 -34.71 78.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.505 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.71 -60.19 2.23 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.389 -169.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.792 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 8.8 p -74.01 -27.31 60.9 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.041 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.1 tm-20 -65.27 -38.25 89.71 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 118.576 -1.25 . . . . 0.0 109.783 171.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -64.74 -43.29 93.82 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.878 176.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -103.54 26.12 8.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.912 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.62 155.61 92.57 Favored Pre-proline 0 C--O 1.235 0.328 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' A' ' 104' ' ' ASN . 53.3 Cg_exo -53.69 164.99 1.95 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.003 2.468 . . . . 0.0 112.482 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.79 31.24 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.499 2.799 . . . . 0.0 113.169 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 102' ' ' PRO . 4.6 m-20 -122.17 94.79 4.41 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.578 176.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.38 92.88 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.2 t70 -91.01 104.59 17.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.324 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.42 ' O ' ' HD2' ' A' ' 110' ' ' LYS . 18.1 tttp -34.73 -74.35 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -167.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 27.7 t -90.82 -9.72 45.41 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.846 -0.533 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.415 ' HB2' ' OD1' ' A' ' 106' ' ' ASP . 3.0 mmm -87.74 -22.04 24.82 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -168.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.582 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -55.12 -45.85 75.57 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.703 0.763 . . . . 0.0 110.82 -173.196 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.646 HG22 HD12 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -53.97 -14.91 1.15 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.114 -1.403 . . . . 0.0 113.112 177.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.646 HD12 HG22 ' A' ' 111' ' ' THR . 1.7 mp -92.02 -39.06 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 -38.48 77.51 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 175.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.849 ' HA ' ' SG ' ' A' ' 117' ' ' CYS . 3.6 m -82.5 -34.07 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 CA-C-O 122.2 1.0 . . . . 0.0 110.347 -176.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.74 -43.38 90.22 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.72 173.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.588 ' HB2' ' HE2' ' A' ' 119' ' ' LYS . 22.5 ptt? -68.36 -20.01 64.68 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.301 -0.96 . . . . 0.0 112.111 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.864 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 1.4 m -66.85 -30.5 70.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 118.844 0.747 . . . . 0.0 109.228 170.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.05 -46.36 57.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.588 ' HE2' ' HB2' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.58 -21.97 62.62 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.57 177.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.864 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.22 -48.87 77.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 169.245 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.4 -52.12 66.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.09 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -56.95 -35.68 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 117.726 0.239 . . . . 0.0 110.906 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -72.72 -17.57 61.6 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.07 -35.02 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 122.022 -0.424 . . . . 0.0 110.576 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 82.2 mt . . . . . 0 C--N 1.326 -0.447 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.239 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo . . . . . 0 N--CA 1.456 -0.702 0 N-CA-C 113.243 0.439 . . . . 0.0 113.243 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -51.62 -74.17 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.726 HD11 ' HB2' ' A' ' 82' ' ' ALA . 27.3 mm -91.03 -16.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.005 0.431 . . . . 0.0 111.89 177.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.5 tpt -69.73 -34.81 74.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -100.27 105.32 16.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 9' ' ' SER . 6.1 t-20 -61.55 112.57 2.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.868 -174.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.598 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -64.57 -23.22 67.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.433 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.435 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m -63.65 -40.23 96.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.057 0.456 . . . . 0.0 109.84 175.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.95 -30.14 58.55 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.64 -51.97 43.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -56.44 -79.48 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.642 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.81 39.85 40.38 Favored Glycine 0 C--N 1.346 1.137 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.338 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -62.79 -42.45 99.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.863 0.332 . . . . 0.0 111.665 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.764 ' H ' HD21 ' A' ' 55' ' ' LEU . . . -144.55 105.01 4.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.059 0.456 . . . . 0.0 111.403 -177.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttm -75.45 -42.11 54.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.263 0.554 . . . . 0.0 110.76 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -63.36 -22.66 67.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.644 -175.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -88.0 -25.37 23.17 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.92 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' HD23 ' A' ' 23' ' ' LEU . 14.7 m -71.91 -33.85 68.63 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 170.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 25' ' ' LEU . 48.8 tptt -58.88 -55.28 37.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.911 175.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.1 -44.45 65.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.039 -174.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 19.6 tp10 -64.59 -39.27 93.43 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.728 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 4.4 mm? -82.43 -19.71 38.44 Favored 'General case' 0 CA--C 1.514 -0.435 0 O-C-N 122.213 -0.305 . . . . 0.0 110.479 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m 61.63 46.76 6.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -168.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 23' ' ' LEU . 20.5 mt -62.72 121.59 68.91 Favored Pre-proline 0 N--CA 1.453 -0.32 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.067 -170.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.615 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 24.0 Cg_exo -61.54 149.67 88.72 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.115 1.877 . . . . 0.0 110.427 176.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -59.97 -35.16 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.744 0.306 . . . . 0.0 110.973 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.3 m -69.16 -39.4 78.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.507 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 80.7 t -74.23 -52.97 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.719 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.9 p -57.53 -37.02 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.175 0.512 . . . . 0.0 110.273 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.33 61.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.221 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -71.78 -23.46 61.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.054 0.455 . . . . 0.0 110.716 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.63 -50.75 69.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.462 ' CE2' HG22 ' A' ' 30' ' ' VAL . 10.0 m-85 -77.28 10.61 2.36 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -57.54 130.49 46.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -72.46 -37.18 68.58 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -171.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 45.1 p90 -92.34 131.69 37.33 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.415 178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.439 ' H ' ' HG2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -89.38 73.31 7.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.546 0.689 . . . . 0.0 110.57 -178.129 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.491 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 36.3 t70 -42.7 -33.32 0.71 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.7 t0 67.2 51.27 0.93 Allowed 'General case' 0 C--N 1.348 0.531 0 CA-C-O 122.186 0.993 . . . . 0.0 109.715 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.491 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -91.62 178.03 6.04 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.159 174.431 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 44' ' ' THR . 25.7 t -83.33 117.93 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 29.4 ttp -67.65 92.85 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.185 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 42' ' ' VAL . 66.5 p -95.91 -8.78 33.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.527 -174.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 10.7 t70 -97.08 134.58 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.267 0.556 . . . . 0.0 111.503 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.613 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 6.2 mpt_? -76.31 -21.1 56.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.119 -174.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.615 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 3.9 mm? -79.64 -15.23 57.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.212 -176.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.41 -61.87 1.73 Allowed 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -176.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.69 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -42.45 -48.01 5.75 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.402 168.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 m -67.27 -44.46 79.26 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.581 1.191 . . . . 0.0 111.823 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.42 36.95 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.015 -0.428 . . . . 0.0 111.701 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.92 -29.37 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.424 ' O ' ' HB ' ' A' ' 57' ' ' THR . 23.3 t-20 -146.25 70.81 1.23 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.406 0.622 . . . . 0.0 110.707 175.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 58' ' ' LYS . 8.9 p -98.36 -41.77 7.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.901 174.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.764 HD21 ' H ' ' A' ' 15' ' ' ALA . 1.7 tm? -55.87 -66.0 0.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.057 0.456 . . . . 0.0 111.068 -176.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -82.75 -16.38 48.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.584 -169.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.43 HG23 ' CG2' ' A' ' 61' ' ' VAL . 23.7 m -84.16 -39.62 19.19 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.788 174.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.688 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 22.8 mmtt -81.62 -2.55 50.6 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.063 -0.398 . . . . 0.0 111.567 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 9.8 mt -64.99 -67.65 0.42 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.505 166.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -178.9 101.33 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.114 0.259 . . . . 0.0 110.978 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.43 ' CG2' HG23 ' A' ' 57' ' ' THR . 30.4 m -148.95 50.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-O 121.35 0.595 . . . . 0.0 111.169 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.644 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 5.9 m -99.9 120.58 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.85 -0.531 . . . . 0.0 110.915 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 69' ' ' HIS . 1.8 t70 -75.2 -57.73 1.66 Allowed Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.639 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 19.4 Cg_endo -98.68 -139.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.237 2.624 . . . . 0.0 113.058 -168.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 4.0 m-20 -72.63 10.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.244 -176.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.81 -70.02 0.52 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.808 HD22 HD23 ' A' ' 68' ' ' LEU . 2.5 p-10 -75.09 154.43 37.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.86 -0.67 . . . . 0.0 111.468 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.808 HD23 HD22 ' A' ' 67' ' ' ASN . 4.6 mm? 68.99 33.78 3.34 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.695 172.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.1 p80 -79.68 69.87 6.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.914 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 2.5 p-80 -85.67 -33.24 21.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.249 177.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.41 -62.84 4.75 Favored Glycine 0 CA--C 1.511 -0.216 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.382 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' A' ' 63' ' ' ASP . 11.1 t-20 -57.52 -30.49 65.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.61 -0.295 . . . . 0.0 111.532 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.73 -36.39 65.18 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.178 0.514 . . . . 0.0 111.372 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 24.4 mmmt -80.37 -35.03 35.96 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.18 -38.8 90.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.619 ' CZ ' ' HB1' ' A' ' 56' ' ' ALA . 48.8 t80 -56.11 -43.42 78.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.923 175.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.55 -34.02 71.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.969 0.414 . . . . 0.0 111.212 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.0 mtt -74.6 -34.86 62.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.669 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.915 ' HE2' ' HA ' ' A' ' 79' ' ' LYS . 9.5 mmpt? -91.37 -10.13 42.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.551 -0.459 . . . . 0.0 111.138 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -143.5 93.87 2.53 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 128.83 -75.5 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.543 174.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.726 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -98.36 151.41 20.56 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.537 0.208 . . . . 0.0 110.743 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.585 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.4 p-10 -91.84 172.95 8.12 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -58.04 -38.08 75.6 Favored 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -170.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 8.0 t -62.44 -35.95 80.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.526 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.438 ' O ' HD13 ' A' ' 90' ' ' LEU . 59.1 mtp -83.05 -39.12 21.63 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -176.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.63 -34.41 72.76 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.59 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.791 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.36 -23.61 54.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.484 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.8 mm-40 -77.81 -25.04 48.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.8 mp -85.37 -46.26 11.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.409 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.791 HG22 ' HA ' ' A' ' 88' ' ' GLN . 6.3 m -58.62 -32.33 45.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.38 -44.46 75.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 0.0 110.184 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.721 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.7 mp -68.76 -41.97 82.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.274 177.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 65.3 mt -56.98 -49.26 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 0.0 110.026 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -72.52 -36.36 68.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.276 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.44 -45.96 5.97 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.051 -172.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.571 ' SG ' HG23 ' A' ' 93' ' ' ILE . 83.5 m -70.74 -39.86 73.06 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.878 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.6 tm-20 -63.34 -38.23 90.36 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.222 0.465 . . . . 0.0 110.449 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -68.22 -36.04 78.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 110.939 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.3 m -96.69 7.79 45.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 111.272 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.19 144.6 84.82 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.1 -176.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 35.4 Cg_exo -61.14 146.12 97.95 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.347 2.032 . . . . 0.0 110.124 174.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 37.9 Cg_exo -57.07 91.14 0.05 OUTLIER 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.967 2.445 . . . . 0.0 113.256 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -125.97 93.47 3.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 175.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -81.3 63.45 5.63 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 0.0 110.927 -175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.778 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.3 t70 -124.18 112.36 16.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.213 172.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -34.09 -55.0 0.5 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.7 t -88.19 -30.55 19.66 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.032 0.833 . . . . 0.0 112.294 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.778 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 73.2 mmm -65.28 -36.25 83.5 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 111' ' ' THR . 5.6 ptpt -57.79 -48.39 79.83 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.818 0.818 . . . . 0.0 110.346 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.622 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -57.46 -10.66 1.52 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.602 174.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.69 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.1 mp -89.84 -41.36 13.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 4.4 m-20 -59.66 -35.49 74.53 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.362 174.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.581 HG22 ' HA ' ' A' ' 111' ' ' THR . 7.1 m -80.76 -35.49 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.046 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.41 -51.57 68.92 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.337 0.589 . . . . 0.0 111.472 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.701 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.97 -25.17 64.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.251 179.538 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.5 t -68.57 -27.03 65.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.745 175.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.721 ' HB2' HG21 ' A' ' 93' ' ' ILE . 66.3 t80 -74.36 -44.31 52.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.285 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.567 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 1.2 pttp -70.49 -29.72 66.32 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.174 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.701 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.34 -56.18 23.01 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.958 0.409 . . . . 0.0 110.322 169.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -61.95 -42.28 98.93 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 175.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.1 -33.67 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 118.488 0.586 . . . . 0.0 111.078 175.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -71.59 -32.22 67.8 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.244 -0.285 . . . . 0.0 111.659 174.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.2 tttt -68.56 -35.84 77.95 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.317 0.58 . . . . 0.0 110.116 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.431 173.149 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo . . . . . 0 C--O 1.23 0.113 0 CA-C-O 121.061 0.359 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.46 -65.98 0.47 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.289 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 4' ' ' ILE . 9.2 tp -72.46 -15.2 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-O 121.126 0.489 . . . . 0.0 111.188 178.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.2 ttt -71.22 -24.94 62.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.91 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -100.33 94.08 6.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.908 174.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -64.12 138.93 58.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.278 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.7 -43.07 84.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.755 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.4 m -62.3 -36.56 82.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.98 -36.88 62.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.011 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.93 -55.82 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.956 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -48.97 -72.41 0.05 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.24 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.36 29.61 46.86 Favored Glycine 0 C--N 1.347 1.141 0 C-N-CA 121.039 -0.6 . . . . 0.0 113.772 -177.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.449 ' H ' HD11 ' A' ' 55' ' ' LEU . 64.8 tttm -85.89 -37.26 19.32 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.14 0.47 . . . . 0.0 110.718 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.589 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.38 56.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.088 0.471 . . . . 0.0 111.314 -177.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.1 ttm -72.38 -38.48 68.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.155 0.502 . . . . 0.0 110.12 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.72 -34.43 74.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.905 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -90.42 -25.35 20.41 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.53 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 12.3 p -74.95 -33.0 61.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.824 ' HA ' HD22 ' A' ' 25' ' ' LEU . 9.9 tptm -57.11 -50.86 71.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.611 172.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -70.3 -42.65 71.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.44 -36.04 82.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.538 0.209 . . . . 0.0 111.339 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 50' ' ' CYS . 11.3 mt -81.03 -3.75 52.86 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.753 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.1 t 65.45 27.83 11.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.811 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.824 HD22 ' HA ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -55.01 119.86 25.34 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.012 176.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -75.01 156.86 42.98 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.774 2.316 . . . . 0.0 111.435 174.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.67 ' HA ' HG22 ' A' ' 30' ' ' VAL . 12.6 p-10 -66.73 -22.59 66.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.17 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 p -68.48 -39.76 81.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.0 110.761 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.35 -50.87 42.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.379 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 27' ' ' ASP . 17.3 m -58.9 -33.6 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.393 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -50.45 67.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.499 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.43 -37.14 86.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.313 0.577 . . . . 0.0 110.01 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mt -57.91 -54.83 42.53 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.056 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -74.88 8.99 2.09 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -176.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -63.24 130.96 46.77 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.349 0.522 . . . . 0.0 110.771 -178.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -74.47 -31.68 62.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.142 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 -81.23 118.0 22.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.778 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.518 ' O ' ' HD3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -81.44 72.95 8.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.351 0.596 . . . . 0.0 111.754 -177.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.531 ' HB3' ' CD2' ' A' ' 41' ' ' TYR . 18.7 t70 -44.94 -44.64 9.94 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 173.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.51 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 20.6 m-20 75.01 70.9 0.09 Allowed 'General case' 0 C--N 1.35 0.607 0 CA-C-O 121.522 0.677 . . . . 0.0 110.489 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.531 ' CD2' ' HB3' ' A' ' 39' ' ' ASP . 9.1 p90 -117.73 176.68 5.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.455 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 44' ' ' THR . 6.2 t -92.16 121.06 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.444 ' O ' HG21 ' A' ' 112' ' ' ILE . 41.6 ttm -62.25 100.93 0.19 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.519 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 42' ' ' VAL . 67.9 p -99.32 -23.64 15.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -83.82 134.21 34.72 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.5 0.667 . . . . 0.0 111.484 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.795 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 9.5 mpt_? -74.88 -21.87 58.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.465 -175.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' A' ' 25' ' ' LEU . 2.7 mm? -79.5 -13.04 59.83 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.455 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -61.69 1.89 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -41.07 -48.48 4.34 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 114.901 -1.045 . . . . 0.0 114.293 169.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.604 ' HB3' HD13 ' A' ' 23' ' ' LEU . 15.4 m -68.75 -38.86 80.42 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.49 1.145 . . . . 0.0 111.947 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.31 -23.97 67.49 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 48' ' ' ALA . 70.1 mt -61.96 -37.34 78.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 121.264 0.554 . . . . 0.0 110.622 177.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.491 HD22 ' N ' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -132.88 85.47 2.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.803 0.811 . . . . 0.0 110.076 -178.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 24.4 p -119.01 -46.34 2.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.504 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.589 HD11 ' H ' ' A' ' 15' ' ' ALA . 1.5 tt -58.76 -67.07 0.4 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.041 0.448 . . . . 0.0 111.382 -171.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.565 ' HA ' HD12 ' A' ' 59' ' ' LEU . . . -82.04 -14.72 55.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 110.889 -173.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 HG11 ' A' ' 61' ' ' VAL . 1.4 m -83.04 -35.39 25.8 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.527 ' NZ ' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.56 -16.31 49.02 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.199 -0.601 . . . . 0.0 110.069 174.373 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 56' ' ' ALA . 24.9 mt -64.63 -64.99 0.74 Allowed 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 121.164 -0.215 . . . . 0.0 111.206 172.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -174.61 126.2 0.31 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 -177.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.486 HG11 HG23 ' A' ' 57' ' ' THR . 14.6 p 179.89 38.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 122.348 1.07 . . . . 0.0 109.193 -173.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.693 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 25.2 m -105.17 118.56 52.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.198 -172.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -69.37 -56.01 8.96 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.534 175.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.3 Cg_endo -98.28 -142.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 123.537 2.825 . . . . 0.0 113.524 -172.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -72.13 -2.98 20.6 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.866 -174.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.58 -66.22 0.46 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -174.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.1 p-10 -71.37 153.73 42.1 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.683 -0.759 . . . . 0.0 110.842 178.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.464 ' HB2' HD22 ' A' ' 67' ' ' ASN . 0.1 OUTLIER 68.47 32.92 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.567 169.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.693 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.7 p80 -74.61 69.18 1.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.864 0.84 . . . . 0.0 110.841 175.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 64.2 t60 -86.95 -60.79 1.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.858 -176.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.52 -53.45 45.85 Favored Glycine 0 N--CA 1.461 0.365 0 C-N-CA 121.223 -0.513 . . . . 0.0 113.096 -175.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -56.05 -34.05 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.633 0.254 . . . . 0.0 111.484 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.479 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -74.61 -33.95 62.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.146 0.498 . . . . 0.0 110.744 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 78' ' ' MET . 23.2 mmmt -79.04 -35.32 42.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.35 -40.2 95.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.004 174.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -59.7 -36.74 77.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.531 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -36.25 75.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.901 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 50.8 mtt -67.78 -33.35 74.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.958 0.409 . . . . 0.0 110.782 -177.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -91.27 -10.54 41.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.026 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -145.72 94.4 2.49 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.541 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.4 -60.92 0.41 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.065 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.3 147.28 26.14 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.133 -0.534 . . . . 0.0 110.474 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 86' ' ' MET . 3.6 m-20 -75.72 146.92 39.74 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 173.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.838 ' HG3' HE21 ' A' ' 88' ' ' GLN . 0.2 OUTLIER -67.53 -47.29 70.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.15 -39.67 44.17 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.87 169.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.574 ' HB3' ' HB2' ' A' ' 83' ' ' ASP . 0.8 OUTLIER -82.82 -37.88 23.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -173.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.551 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -60.79 -41.03 94.8 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.993 174.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.838 HE21 ' HG3' ' A' ' 84' ' ' GLU . 2.6 mp0 -71.29 -27.21 63.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.653 -173.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.469 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -84.77 -22.07 29.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.742 173.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.7 tt -86.12 -42.53 13.81 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.06 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.478 HG13 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -58.76 -32.98 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 122.944 0.498 . . . . 0.0 111.948 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.73 -42.29 97.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.015 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -62.59 -41.49 92.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.012 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.545 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 34.2 mt -56.94 -47.65 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.385 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -67.62 -35.98 79.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.293 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.2 -46.65 5.8 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.183 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.733 ' HB2' HG12 ' A' ' 114' ' ' VAL . 43.7 m -73.4 -35.2 65.82 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.783 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 6.1 mt-10 -66.12 -37.24 85.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.864 0.756 . . . . 0.0 111.029 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -64.02 -42.24 97.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.869 0.366 . . . . 0.0 110.473 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.9 m -100.36 22.62 11.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.208 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.6 156.81 70.47 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.063 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -44.41 141.4 5.22 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.892 2.395 . . . . 0.0 111.819 177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.02 22.97 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.872 2.381 . . . . 0.0 113.666 -171.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -115.21 94.14 4.6 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -74.31 97.7 3.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.194 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.535 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 8.7 t70 -89.3 115.52 26.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.854 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -29.72 -63.35 0.13 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.18 1.55 . . . . 0.0 113.627 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 9.9 t -96.89 -12.84 22.96 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -175.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.795 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 3.1 mmm -86.75 -26.18 24.32 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -170.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.635 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -54.36 -44.89 72.58 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.076 0.941 . . . . 0.0 110.852 -171.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.635 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.8 t -57.84 -13.2 3.92 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.806 -1.543 . . . . 0.0 113.092 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.552 HD12 HG23 ' A' ' 111' ' ' THR . 1.7 mp -91.17 -37.97 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.48 -38.27 77.26 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.79 175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.733 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -78.95 -36.28 18.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 121.283 0.563 . . . . 0.0 110.265 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.47 -46.83 88.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.645 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.656 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 21.9 ptt? -69.57 -17.61 63.57 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.628 176.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.63 -30.1 64.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.756 0.788 . . . . 0.0 109.071 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -82.06 -39.77 22.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.669 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.6 -24.27 63.64 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 118.833 -1.147 . . . . 0.0 110.279 177.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.656 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.16 -54.99 27.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.991 160.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.54 -49.61 76.78 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 178.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.742 HG22 ' HA ' ' A' ' 119' ' ' LYS . 8.7 tt -57.77 -34.44 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 122.009 -0.432 . . . . 0.0 110.961 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -70.45 -29.5 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 177.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -63.04 -34.5 77.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.3 mt . . . . . 0 CA--C 1.54 0.575 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.182 173.905 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo . . . . . 0 N--CA 1.473 0.322 0 CA-C-O 121.009 0.337 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.62 -69.19 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.624 179.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -77.83 -10.7 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.075 0.464 . . . . 0.0 111.215 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.503 ' HA ' ' CE ' ' A' ' 5' ' ' MET . 2.6 tpt -65.33 -39.72 92.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.119 0.485 . . . . 0.0 110.065 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -82.41 103.48 12.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.743 174.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -63.74 148.43 49.18 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.46 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.457 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 9.7 mp -58.92 -52.65 64.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.088 -176.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.9 m -63.3 -33.28 75.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.738 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -72.43 -37.27 68.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.556 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.35 -54.73 13.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.853 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 24.8 m-85 -44.73 -69.11 0.15 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.646 171.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.73 33.93 63.91 Favored Glycine 0 C--N 1.342 0.899 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.05 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -67.46 -53.6 27.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 117.598 0.699 . . . . 0.0 109.537 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.427 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.79 88.17 1.89 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.106 0.479 . . . . 0.0 111.09 176.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.0 ttm -69.97 -35.53 74.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.09 -36.55 84.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.548 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -89.47 -25.27 21.55 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.687 -0.805 . . . . 0.0 111.452 -172.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.427 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -68.83 -35.69 77.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 170.051 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -61.55 -46.81 88.35 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.922 175.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -69.79 -43.62 71.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.867 -176.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -70.58 -33.61 71.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -174.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.663 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 7.0 mt -86.97 -4.5 59.18 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.434 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m 59.09 43.42 17.46 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.359 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 4.3 mm? -49.77 120.62 11.37 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.9 174.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.652 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 12.3 Cg_exo -72.67 154.4 54.49 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 121.941 1.761 . . . . 0.0 110.814 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.704 ' HA ' HG22 ' A' ' 30' ' ' VAL . 15.0 p-10 -64.13 -27.36 69.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.826 -176.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 m -65.93 -36.26 82.87 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.122 0.487 . . . . 0.0 110.381 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.445 HG11 ' CB ' ' A' ' 47' ' ' LEU . 19.9 t -82.35 -41.04 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.476 -176.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.4 m -58.87 -33.19 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.838 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.98 -51.95 53.86 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.539 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.9 -37.2 86.52 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.7 tp -51.48 -51.74 52.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.63 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -67.84 11.56 0.14 Allowed 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.597 HD22 ' HB3' ' A' ' 39' ' ' ASP . 27.5 p-10 -59.67 111.11 1.31 Allowed 'General case' 0 C--N 1.346 0.429 0 CA-C-N 120.522 1.51 . . . . 0.0 111.382 -174.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -95.46 -2.66 48.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.925 0.393 . . . . 0.0 111.249 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 p90 -91.14 160.51 15.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.139 177.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.879 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -73.26 80.23 1.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 122.074 0.94 . . . . 0.0 110.619 176.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB3' HD22 ' A' ' 35' ' ' ASN . 4.7 p-10 -44.82 -53.33 7.58 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.9 p30 49.02 33.06 4.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.595 0.758 . . . . 0.0 111.147 -169.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.56 177.37 4.87 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.69 -176.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.4 t -101.71 136.11 35.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.898 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.405 ' HB3' ' HE2' ' A' ' 43' ' ' MET . 51.8 ttp -70.75 101.46 2.1 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -97.72 -40.82 8.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.257 -173.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 47' ' ' LEU . 8.5 t70 -86.44 120.17 27.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.355 0.598 . . . . 0.0 112.052 -173.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.804 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -44.21 -42.28 6.4 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 114.493 -1.23 . . . . 0.0 113.155 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.701 HD22 ' HG2' ' A' ' 46' ' ' ARG . 3.7 mm? -64.67 -19.47 65.75 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 122.262 -0.274 . . . . 0.0 111.45 -175.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.531 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.08 -59.79 2.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -178.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.54 -47.46 2.95 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-N 115.097 -0.956 . . . . 0.0 114.467 166.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HB3' HD13 ' A' ' 23' ' ' LEU . 30.0 m -63.41 -43.76 96.6 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.489 1.144 . . . . 0.0 111.22 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.52 -23.79 66.29 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.531 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.0 mm -63.86 -34.24 66.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.108 0.48 . . . . 0.0 110.594 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -140.1 63.18 1.48 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.187 0.518 . . . . 0.0 111.277 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.431 ' CB ' HD11 ' A' ' 23' ' ' LEU . 28.7 p -114.54 -38.65 3.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 177.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.3 tt -62.72 -55.63 24.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.551 -170.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.1 -13.69 58.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.079 0.466 . . . . 0.0 110.42 -173.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.509 HG23 HG11 ' A' ' 61' ' ' VAL . 36.7 m -82.97 -35.89 25.56 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.54 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.449 ' NZ ' ' HB3' ' A' ' 58' ' ' LYS . 9.0 mtpm? -81.53 -16.03 53.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.265 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.2 mt -65.62 -65.32 0.69 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.255 170.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -175.7 121.31 0.19 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.706 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.509 HG11 HG23 ' A' ' 57' ' ' THR . 11.5 p -177.28 36.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.477 1.132 . . . . 0.0 109.12 -178.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.593 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.2 m -103.88 117.52 49.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.42 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -54.41 7.54 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.956 177.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -96.41 -145.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.911 2.407 . . . . 0.0 112.906 -173.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.468 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.1 m-20 -76.71 10.14 2.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.376 -176.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.72 -69.56 0.52 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.683 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.3 p-10 -69.12 149.42 48.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.712 -0.744 . . . . 0.0 111.36 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.618 HD23 HD22 ' A' ' 67' ' ' ASN . 4.0 mm? 69.7 31.69 3.5 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.593 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 16.5 p-80 -74.74 68.86 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.314 0.578 . . . . 0.0 110.878 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -86.39 -49.02 7.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.926 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.15 -53.7 43.54 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.582 -174.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -62.01 -27.67 69.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -36.64 73.22 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.672 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -80.03 -35.65 36.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.74 -37.58 88.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.402 173.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -63.07 -35.96 81.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.172 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.23 -37.05 74.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 81.0 mtp -74.44 -39.01 62.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.358 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -82.98 -12.34 57.38 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.804 0.335 . . . . 0.0 110.292 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -144.4 94.56 2.58 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.342 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.83 -64.94 0.47 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.046 -1.073 . . . . 0.0 113.428 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.23 138.34 41.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.032 0.444 . . . . 0.0 111.833 -175.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.612 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -84.05 174.46 10.27 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 172.246 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 30.1 mt-10 -62.22 -35.38 78.72 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.47 -167.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.798 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 12.7 t -61.76 -38.37 87.75 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.751 -177.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 65.4 mtm -81.32 -39.38 25.24 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -174.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.58 -39.74 89.17 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.279 173.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.73 -26.4 60.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.709 -177.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.798 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.7 mm-40 -78.46 -23.56 46.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.619 177.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.642 ' O ' HG13 ' A' ' 94' ' ' ILE . 3.4 mm? -85.26 -49.04 8.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.961 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 88' ' ' GLN . 19.9 m -57.99 -39.39 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -172.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.14 -43.06 71.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.869 0.366 . . . . 0.0 110.536 -176.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.762 HG23 ' SG ' ' A' ' 97' ' ' CYS . 3.2 mm -63.43 -42.12 95.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.335 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.686 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.8 mt -51.55 -47.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.622 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.1 m170 -70.87 -36.46 72.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.166 0.508 . . . . 0.0 110.639 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.55 -49.5 4.6 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.334 -172.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.773 ' HB2' HG12 ' A' ' 114' ' ' VAL . 57.9 m -71.39 -35.76 71.16 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.867 -177.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.686 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 1.3 mt-10 -63.92 -37.73 88.48 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.603 0.638 . . . . 0.0 110.88 172.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.22 -35.87 82.21 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.041 0.448 . . . . 0.0 110.546 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.5 m -107.43 25.51 11.36 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -87.32 149.64 47.41 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -175.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.16 149.24 81.6 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.364 2.043 . . . . 0.0 110.288 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -66.45 71.87 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.857 2.372 . . . . 0.0 113.146 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -99.73 91.66 4.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -81.2 77.27 8.11 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.962 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.723 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.7 t70 -145.3 128.43 16.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.733 174.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HE2' ' HB3' ' A' ' 107' ' ' LYS . 13.4 ttpt -29.25 -55.87 0.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 125.024 1.453 . . . . 0.0 114.508 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.444 ' CB ' ' HB2' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -93.72 -16.97 23.69 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 90.3 mmm -74.3 -32.14 62.76 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 121.841 -0.537 . . . . 0.0 111.731 -172.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.723 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -62.71 -49.53 74.71 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.692 0.758 . . . . 0.0 109.853 178.013 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.723 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.06 -14.21 6.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.468 175.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.501 ' O ' ' HG2' ' A' ' 116' ' ' MET . 0.5 OUTLIER -89.27 -39.71 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 12.2 t70 -62.94 -35.38 79.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.484 177.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.773 HG12 ' HB2' ' A' ' 97' ' ' CYS . 15.8 m -79.42 -38.15 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.025 0.441 . . . . 0.0 110.168 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.44 -49.1 78.92 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-O 121.544 0.688 . . . . 0.0 111.304 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.512 ' HA ' ' HD3' ' A' ' 119' ' ' LYS . 25.0 ptt? -69.58 -19.85 63.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.06 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.863 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 8.5 t -72.79 -24.17 60.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.482 ' HE1' ' HB3' ' A' ' 89' ' ' GLN . 57.6 t80 -77.76 -40.58 40.41 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.424 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.2 pttp -67.82 -29.62 68.82 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 118.725 -1.19 . . . . 0.0 110.348 176.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.863 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.99 -54.62 44.89 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.625 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.45 ' HG3' HD11 ' A' ' 93' ' ' ILE . 14.4 mm-40 -58.71 -52.03 67.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.844 176.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -54.91 -36.63 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -70.86 -32.15 69.07 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.302 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -71.18 -33.94 70.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.214 0.53 . . . . 0.0 110.393 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--N 1.326 -0.453 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.546 173.782 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 98.5 Cg_endo . . . . . 0 CA--C 1.531 0.354 0 CA-C-O 120.653 0.189 . . . . 0.0 112.515 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -51.1 -70.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.784 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -78.98 -9.48 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 121.149 0.499 . . . . 0.0 111.183 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 26.0 ttt -71.48 -30.09 65.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.33 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 1.8 tpmt? -89.28 103.84 16.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.768 176.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.586 ' HB2' ' HB3' ' A' ' 10' ' ' ASN . 6.3 m120 -84.85 127.57 34.21 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.771 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.3 mp -60.13 -52.99 63.0 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -176.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -64.57 -26.83 68.58 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.447 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.586 ' HB3' ' HB2' ' A' ' 7' ' ' ASN . 27.9 t-20 -75.62 -34.31 60.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.494 177.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -74.5 -55.4 5.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.943 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -50.08 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.94 45.28 81.5 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 120.669 -0.777 . . . . 0.0 113.051 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.53 -60.24 3.95 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.829 0.347 . . . . 0.0 110.988 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -150.5 93.76 2.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.54 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 ttp -74.07 -31.01 62.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.68 -30.42 63.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.252 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -88.06 -26.21 22.66 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.037 -175.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 82.8 m -75.71 -31.04 59.49 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 170.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 1.029 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 23.4 tptp -56.18 -50.11 72.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.327 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.775 -178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -69.74 -37.29 76.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -173.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.888 ' HB2' HD12 ' A' ' 25' ' ' LEU . 16.0 mt -86.22 -6.28 59.01 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.132 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.7 t 59.53 43.82 15.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.435 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 1.029 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 10.3 mp -50.14 124.87 18.14 Favored Pre-proline 0 N--CA 1.47 0.559 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.313 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.582 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 11.1 Cg_exo -71.86 151.26 56.73 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.256 1.971 . . . . 0.0 110.072 170.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 30' ' ' VAL . 1.5 p30 -66.29 -26.01 67.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.847 0.356 . . . . 0.0 111.218 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 p -65.76 -32.91 74.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.07 0.462 . . . . 0.0 110.7 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.492 HG11 ' HB2' ' A' ' 47' ' ' LEU . 23.8 t -79.04 -42.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.37 -177.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 27' ' ' ASP . 34.8 m -59.61 -29.22 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.126 0.489 . . . . 0.0 109.745 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.65 -52.71 41.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.6 176.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.97 -36.31 81.91 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.323 0.583 . . . . 0.0 109.747 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.8 tp -47.09 -55.67 7.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.253 173.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -66.58 10.07 0.14 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -65.78 116.18 6.7 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 120.393 1.451 . . . . 0.0 109.895 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -78.26 -28.79 47.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.289 -176.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -82.66 98.08 8.85 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -174.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -91.35 67.5 5.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.984 -174.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -63.47 13.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.06 70.47 0.65 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 119.087 0.858 . . . . 0.0 110.096 -169.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -103.05 171.07 7.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.574 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.8 t -90.67 113.56 26.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.211 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.553 ' O ' HG21 ' A' ' 112' ' ' ILE . 40.4 ttm -79.25 95.5 5.67 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.809 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.1 p -93.22 -18.0 23.03 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -84.88 133.81 34.3 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.811 0.815 . . . . 0.0 110.517 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HE ' ' CG ' ' A' ' 106' ' ' ASP . 9.9 mpt_? -68.98 -31.49 70.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.084 -1.416 . . . . 0.0 109.769 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.582 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.4 mm? -75.11 -14.88 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.04 -58.29 2.75 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.453 ' O ' HG22 ' A' ' 52' ' ' ILE . . . -38.64 -45.01 1.91 Allowed Glycine 0 CA--C 1.534 1.261 0 CA-C-N 114.919 -1.037 . . . . 0.0 114.655 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.446 ' HB3' HD13 ' A' ' 23' ' ' LEU . 4.1 m -76.24 -44.92 35.27 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.473 1.136 . . . . 0.0 112.247 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.4 -23.87 63.78 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 49' ' ' GLY . 14.7 tt -71.72 -19.86 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 0.0 110.945 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -144.08 85.24 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.229 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 23.9 t -121.76 -45.24 2.29 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.55 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.433 ' H ' HD22 ' A' ' 55' ' ' LEU . 3.2 mm? -58.25 -49.07 78.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.97 0.414 . . . . 0.0 111.51 -174.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.53 -15.67 51.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.962 0.41 . . . . 0.0 110.921 -174.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -83.78 -34.63 24.72 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.396 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 43.2 mtpt -82.92 -12.92 56.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.199 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.27 -64.09 0.95 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.888 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -175.05 111.7 0.13 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.467 HG12 ' O ' ' A' ' 57' ' ' THR . 8.1 p -176.0 32.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-O 121.327 0.584 . . . . 0.0 111.497 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.583 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.8 m -109.65 117.58 54.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.28 -0.888 . . . . 0.0 111.659 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 69' ' ' HIS . 0.1 OUTLIER -65.73 -59.68 8.75 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.485 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.714 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 27.6 Cg_endo -104.87 -139.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.52 2.813 . . . . 0.0 112.607 -171.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.472 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -72.13 -0.3 11.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.153 -177.652 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.78 -75.7 0.27 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.995 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.714 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.7 p-10 -70.06 152.68 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.084 -0.558 . . . . 0.0 111.637 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.528 HD23 HD22 ' A' ' 67' ' ' ASN . 4.6 mm? 70.98 27.67 3.34 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.504 0.722 . . . . 0.0 112.325 174.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ASP . 4.4 p80 -74.65 68.12 1.62 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 111.119 171.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -87.49 -31.66 19.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.395 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.6 -63.33 3.77 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.953 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 7.9 m-80 -55.26 -25.43 33.66 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 122.913 0.485 . . . . 0.0 112.087 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.27 -38.09 75.01 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.38 0.61 . . . . 0.0 110.291 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.511 ' HE3' HD13 ' A' ' 94' ' ' ILE . 59.9 mmtt -81.5 -36.43 29.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.762 177.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.598 ' HB3' ' HA ' ' A' ' 72' ' ' ASN . 11.2 t70 -60.58 -40.67 92.58 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.361 174.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -60.83 -42.41 97.69 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.443 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.39 -30.25 68.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.434 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.473 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 84.7 mtp -74.23 -40.88 62.12 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.614 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 13.6 ptpt -94.28 -7.89 40.65 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.456 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.771 ' HB3' HD21 ' A' ' 8' ' ' LEU . 42.5 m-70 -139.91 90.82 2.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.36 176.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.38 -75.74 0.42 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.646 173.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -96.91 149.8 21.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.511 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.2 OUTLIER -84.37 169.4 14.65 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 173.092 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -67.05 -38.22 85.46 Favored 'General case' 0 N--CA 1.411 -2.405 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.148 -168.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.761 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.7 OUTLIER -62.21 -33.51 74.69 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.08 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 7.4 tpt -84.56 -39.98 18.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.493 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.98 -38.97 77.05 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.535 172.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.553 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -71.67 -23.83 61.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.197 -178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.761 ' HG2' ' O ' ' A' ' 85' ' ' THR . 9.0 mm-40 -77.21 -25.75 52.05 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.1 tp -86.95 -44.91 11.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.274 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.553 HG22 ' HA ' ' A' ' 88' ' ' GLN . 26.7 m -57.36 -34.46 46.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.281 -175.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.69 -44.07 78.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -65.46 -41.06 90.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.854 175.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.511 HD13 ' HE3' ' A' ' 74' ' ' LYS . 86.4 mt -55.45 -48.24 77.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.681 -177.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -72.28 -35.26 68.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.897 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.9 -43.71 7.52 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.879 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 93' ' ' ILE . 63.0 m -72.79 -34.54 66.98 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 121.398 -0.121 . . . . 0.0 110.789 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -57.41 -38.38 74.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.819 0.343 . . . . 0.0 110.732 170.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -64.77 -43.23 93.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.168 175.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.1 m -99.0 25.17 6.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.841 0.353 . . . . 0.0 111.745 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 102' ' ' PRO . . . -76.09 148.21 81.04 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.606 178.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 23.9 Cg_exo -64.42 151.38 85.73 Favored 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.672 2.248 . . . . 0.0 111.871 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.4 Cg_exo -70.55 59.3 2.01 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -121.61 116.72 25.13 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -81.12 93.17 6.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.919 0.39 . . . . 0.0 111.249 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.732 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 6.2 m-20 -130.03 97.65 4.53 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.318 0.58 . . . . 0.0 110.152 170.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -42.65 -49.05 5.58 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 176.321 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.06 -24.14 28.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.871 1.214 . . . . 0.0 112.16 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.732 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 2.4 mmm -85.54 -26.72 26.02 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.48 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.1 OUTLIER -56.78 -45.95 81.8 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.737 0.779 . . . . 0.0 111.311 -170.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.56 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -57.93 -14.06 5.62 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.288 177.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.553 HG21 ' O ' ' A' ' 43' ' ' MET . 3.7 mp -90.13 -37.14 9.21 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 176.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -60.09 -35.31 74.93 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.518 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 111' ' ' THR . 16.5 m -81.26 -34.97 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.79 84.44 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.243 0.544 . . . . 0.0 111.653 174.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.573 ' HA ' ' CE ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.523 179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.516 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 43.2 t -73.02 -23.12 60.57 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.863 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.8 t80 -79.76 -46.56 16.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.573 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.17 -25.21 64.24 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 118.499 -1.28 . . . . 0.0 109.345 177.6 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.561 ' HE3' ' O ' ' A' ' 116' ' ' MET . 3.5 ttmt -54.02 -55.69 24.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.166 169.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 27.4 mm-40 -59.11 -40.52 85.62 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.509 173.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.544 HD13 HD12 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -57.23 -35.23 47.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 118.467 0.576 . . . . 0.0 111.349 176.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -72.46 -31.67 65.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.115 0.484 . . . . 0.0 111.135 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -71.0 -22.35 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.556 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.544 HD12 HD13 ' A' ' 122' ' ' ILE . 96.6 mt . . . . . 0 CA--C 1.534 0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.727 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.483 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.3 Cg_exo . . . . . 0 C--O 1.224 -0.19 0 CA-C-O 120.649 0.187 . . . . 0.0 112.518 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -49.25 -68.25 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.823 177.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.8 tp -78.15 -14.3 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.115 0.483 . . . . 0.0 111.447 -177.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.483 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.7 mmm -80.15 -21.43 43.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.5 tttp -90.56 114.11 26.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -88.99 135.04 33.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.457 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.7 mp -58.03 -48.15 80.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.173 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.5 m -60.83 -37.02 80.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.004 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -70.54 -37.22 74.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.841 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -72.09 -56.75 5.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.406 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -58.7 -79.94 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.95 42.08 69.49 Favored Glycine 0 C--N 1.344 0.99 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.726 -171.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -81.9 -36.98 27.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.211 0.529 . . . . 0.0 110.528 -176.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.06 55.74 1.38 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.574 0.702 . . . . 0.0 109.638 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . 0.445 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 53.9 tpp -69.77 -37.71 76.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.709 -177.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -54.09 -38.07 64.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.594 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 30.2 mt-30 -90.67 -27.24 19.14 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.346 -0.542 . . . . 0.0 111.67 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 9.1 p -76.83 -33.04 57.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.777 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 8.9 tptp -57.91 -49.69 75.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.75 172.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.91 -39.94 72.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.393 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 3.2 tm-20 -68.57 -39.27 81.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.201 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -77.37 -4.71 46.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.122 0.487 . . . . 0.0 110.385 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.2 m 65.43 36.3 6.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.504 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.777 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 18.2 mt -65.07 120.09 64.18 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.786 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.581 ' CD ' HD21 ' A' ' 47' ' ' LEU . 7.9 Cg_exo -73.95 163.41 36.96 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.838 2.359 . . . . 0.0 110.444 171.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -62.34 -32.32 73.07 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.408 -174.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -63.95 -52.9 57.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 111.447 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.662 HG21 HD23 ' A' ' 47' ' ' LEU . 59.1 t -70.14 -53.38 23.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.75 -175.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.455 HG22 ' CE2' ' A' ' 34' ' ' TYR . 9.9 p -59.9 -30.01 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.007 -176.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.84 -51.48 40.04 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.05 -34.58 78.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.661 0.743 . . . . 0.0 109.388 178.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -53.82 -38.73 64.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.612 171.214 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.455 ' CE2' HG22 ' A' ' 30' ' ' VAL . 19.6 m-85 -76.28 9.13 2.76 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -65.4 108.01 1.83 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.915 0.78 . . . . 0.0 109.89 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -71.27 -33.57 69.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.732 -175.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 25.9 m-90 -74.13 126.84 31.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.468 0.652 . . . . 0.0 110.294 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.814 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -75.99 69.9 2.64 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.808 -178.711 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.636 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 29.1 t70 -43.62 -23.96 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 176.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.1 t0 67.32 71.4 0.36 Allowed 'General case' 0 C--N 1.351 0.637 0 CA-C-N 118.97 0.804 . . . . 0.0 109.553 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.636 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.2 p90 -124.19 169.84 11.33 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.758 -177.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -90.21 132.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 35.9 ttp -68.95 93.19 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.477 0.656 . . . . 0.0 109.621 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.9 p -88.33 -40.65 13.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.737 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.585 ' OD2' ' HB3' ' A' ' 47' ' ' LEU . 24.1 t70 -80.96 117.74 21.84 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 122.246 1.022 . . . . 0.0 111.059 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.724 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.33 -37.39 62.27 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.066 -1.879 . . . . 0.0 111.792 172.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.662 HD23 HG21 ' A' ' 29' ' ' VAL . 28.3 tp -71.27 -18.06 62.44 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 -173.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.42 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -51.87 8.13 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.95 -46.03 1.7 Allowed Glycine 0 CA--C 1.531 1.073 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.212 165.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.9 m -68.87 -43.42 75.39 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.393 1.097 . . . . 0.0 109.596 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.58 -9.47 58.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.354 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 48' ' ' ALA . 55.9 mt -59.22 -36.17 61.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.05 0.452 . . . . 0.0 110.282 175.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -135.47 84.77 2.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.3 p -102.26 -45.51 5.1 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.9 -178.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 59' ' ' LEU . 61.9 tp -60.64 -57.02 14.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.267 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.22 -15.69 54.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.009 0.433 . . . . 0.0 110.762 -170.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.605 HG23 HG11 ' A' ' 61' ' ' VAL . 96.0 m -74.79 -34.0 62.35 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.556 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 14.8 mmmt -79.36 -25.85 42.16 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.435 177.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.1 mm? -65.42 -64.29 0.9 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.846 172.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -176.27 117.17 0.13 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.691 0.282 . . . . 0.0 110.776 -175.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG23 ' A' ' 57' ' ' THR . 11.2 p -166.43 32.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.239 1.019 . . . . 0.0 109.338 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.715 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 35.5 m -111.28 120.68 62.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.176 -174.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.19 -56.15 2.04 Favored Pre-proline 0 CA--C 1.533 0.318 0 O-C-N 122.277 -0.264 . . . . 0.0 111.43 175.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 10.9 Cg_endo -97.04 -146.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.155 2.57 . . . . 0.0 112.682 -173.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.411 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -74.56 11.76 0.94 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.788 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.77 -68.88 0.54 Allowed Glycine 0 C--N 1.317 -0.49 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.316 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.815 HD22 HD23 ' A' ' 68' ' ' LEU . 3.6 p-10 -70.0 149.5 47.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.43 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.815 HD23 HD22 ' A' ' 67' ' ' ASN . 4.0 mm? 68.69 31.73 4.45 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 173.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.715 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 13.3 p80 -73.9 72.6 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.583 0.706 . . . . 0.0 111.669 176.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -87.34 -47.52 8.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.044 -179.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.63 -59.07 11.51 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.89 -173.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -63.28 -24.18 67.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.29 -36.51 68.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.221 0.534 . . . . 0.0 110.378 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HZ1' ' HB1' ' A' ' 87' ' ' ALA . 3.1 mmmp? -79.91 -33.37 39.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.891 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.653 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 20.9 t70 -64.23 -42.1 96.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.084 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -63.89 -39.52 94.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.82 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.7 -33.7 72.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.164 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 68.7 mtm -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.961 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 3.7 ptpp? -93.16 -14.16 27.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.867 -0.733 . . . . 0.0 111.583 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.868 ' HB3' HD21 ' A' ' 8' ' ' LEU . 47.5 m-70 -139.08 92.64 2.61 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.403 178.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.27 -75.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.579 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.22 146.22 30.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.579 0.228 . . . . 0.0 110.559 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.686 ' OD1' HG22 ' A' ' 85' ' ' THR . 2.5 p30 -87.54 174.71 8.31 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.343 0.592 . . . . 0.0 110.643 173.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -49.46 69.95 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.56 -166.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.76 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.1 t -62.76 -32.27 73.39 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.465 -175.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 72.0 mtp -79.59 -39.46 31.65 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.447 0.641 . . . . 0.0 109.53 -173.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.507 ' HB1' ' HZ1' ' A' ' 74' ' ' LYS . . . -63.14 -31.64 72.84 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.507 176.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.822 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -82.35 -19.61 38.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.8 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.76 ' HG2' ' O ' ' A' ' 85' ' ' THR . 75.4 mm-40 -78.58 -23.68 45.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 94' ' ' ILE . 24.9 tp -85.98 -43.86 12.82 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.006 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.822 HG22 ' HA ' ' A' ' 88' ' ' GLN . 2.8 m -57.67 -29.73 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -175.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -68.08 -43.02 79.51 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.265 0.555 . . . . 0.0 109.865 -178.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.625 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.01 -42.05 85.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.058 175.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.645 HG13 ' O ' ' A' ' 90' ' ' LEU . 27.2 mt -54.95 -47.59 76.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 CA-C-O 120.921 0.391 . . . . 0.0 110.174 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -70.22 -37.07 74.95 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.826 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.94 -48.39 5.2 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.277 -173.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.807 ' HB2' HG12 ' A' ' 114' ' ' VAL . 39.7 m -72.98 -37.42 67.05 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -67.36 -37.36 83.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 117.969 0.349 . . . . 0.0 110.494 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.34 -33.4 75.77 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.814 0.34 . . . . 0.0 110.577 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.7 m -97.73 8.11 45.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.324 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.24 155.51 79.44 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.885 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.512 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 59.6 Cg_exo -52.88 138.21 60.85 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.75 2.3 . . . . 0.0 111.977 176.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.7 Cg_exo -71.28 35.1 0.27 Allowed 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.592 2.861 . . . . 0.0 113.208 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -95.94 119.47 34.49 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.97 96.03 4.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.435 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.943 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.5 t70 -144.38 119.03 9.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.346 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -29.92 -71.83 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.074 1.484 . . . . 0.0 113.776 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.42 ' O ' HD13 ' A' ' 112' ' ' ILE . 81.6 m -88.79 -14.72 36.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -174.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.943 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -63.12 -42.62 99.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.703 0.683 . . . . 0.0 110.453 -178.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.668 ' HG3' ' H ' ' A' ' 111' ' ' THR . 0.6 OUTLIER -64.44 -49.97 69.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.651 0.738 . . . . 0.0 110.422 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.668 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -59.04 -13.4 6.6 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.913 175.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -88.3 -35.86 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.625 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.2 OUTLIER -59.81 -37.56 79.5 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.046 173.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.807 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.7 m -78.02 -38.29 24.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.733 178.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.07 -52.59 64.71 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 121.006 0.432 . . . . 0.0 111.739 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.648 ' SD ' ' HE2' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.4 -24.68 63.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.58 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.92 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 13.8 t -69.09 -25.43 64.42 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.594 0.712 . . . . 0.0 110.142 176.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.609 ' HA ' HG12 ' A' ' 93' ' ' ILE . 75.1 t80 -79.81 -43.09 23.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.133 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.6 pttp -68.12 -28.1 67.04 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.736 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.92 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.42 -54.95 41.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.709 0.29 . . . . 0.0 111.008 173.211 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HG3' ' N ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -59.52 -47.59 84.94 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.346 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.542 ' N ' ' HG3' ' A' ' 121' ' ' GLU . 1.9 tt -59.85 -31.24 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 120.932 0.396 . . . . 0.0 110.943 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -70.6 -30.86 67.65 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 176.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -36.15 69.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.0 mt . . . . . 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.407 174.345 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 N--CA 1.466 -0.132 0 CA-C-O 120.709 0.212 . . . . 0.0 111.738 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 15.7 mp0 -49.93 -69.56 0.11 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.934 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -78.19 -12.94 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.05 0.453 . . . . 0.0 111.495 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 74.5 mmm -79.5 -21.83 44.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 110.958 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -89.11 103.84 16.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.967 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -62.44 136.17 57.78 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.916 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.683 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.5 pt? -56.4 -42.96 78.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.843 178.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.763 ' HB3' HD13 ' A' ' 55' ' ' LEU . 50.8 m -61.44 -30.28 70.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -74.7 -31.66 61.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.083 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -75.6 -49.36 18.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.145 176.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -46.7 -74.2 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 172.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.3 46.04 87.35 Favored Glycine 0 C--N 1.34 0.751 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.661 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.604 ' H ' HD23 ' A' ' 55' ' ' LEU . 87.9 tttt -67.76 -62.03 1.6 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 117.057 0.429 . . . . 0.0 110.987 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.87 102.83 3.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.551 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.4 mmt -70.65 -25.29 62.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.17 0.51 . . . . 0.0 110.168 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.45 -31.11 70.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.777 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -88.87 -25.63 22.05 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.85 -170.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 99.7 m -74.25 -34.58 63.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.189 0.519 . . . . 0.0 109.764 173.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -62.2 -47.29 85.12 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.893 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -76.14 -48.15 21.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.678 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.82 -32.3 72.75 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -174.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.583 ' CB ' HD13 ' A' ' 25' ' ' LEU . 4.1 mm? -88.9 -17.42 29.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.667 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 60.61 36.25 19.77 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -170.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.71 HD23 HG12 ' A' ' 30' ' ' VAL . 2.0 tp -57.08 121.81 49.06 Favored Pre-proline 0 N--CA 1.456 -0.138 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.801 -172.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 17.9 Cg_exo -68.54 155.67 68.22 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.694 2.263 . . . . 0.0 110.804 173.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.697 ' HA ' HG22 ' A' ' 30' ' ' VAL . 52.7 p30 -70.9 -20.53 62.49 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.587 -175.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 m -66.38 -37.52 85.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 109.876 173.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.408 HG21 ' HD2' ' A' ' 26' ' ' PRO . 61.7 t -73.58 -51.43 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.885 -177.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.71 HG12 HD23 ' A' ' 25' ' ' LEU . 35.5 m -57.42 -36.31 52.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 120.937 0.399 . . . . 0.0 110.931 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.62 -51.71 57.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.731 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.14 -25.25 60.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.144 0.497 . . . . 0.0 110.167 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.6 tp -56.59 -52.75 63.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.406 174.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -74.57 10.04 1.52 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -65.36 126.21 27.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.852 0.751 . . . . 0.0 111.184 -175.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -82.87 -35.05 26.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.349 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -72.73 134.25 44.92 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.005 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -77.54 67.76 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.217 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -43.69 -54.71 4.87 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 171.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.0 t70 64.63 70.35 0.49 Allowed 'General case' 0 C--N 1.347 0.472 0 CA-C-O 121.699 0.762 . . . . 0.0 109.919 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -125.59 178.66 5.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.158 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 62.0 t -83.69 128.88 38.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 51.0 ttm -68.03 92.44 0.38 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.253 0.549 . . . . 0.0 109.669 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.1 p -92.12 -32.63 15.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.493 -174.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.44 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 13.7 t70 -70.87 129.84 40.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.401 0.62 . . . . 0.0 111.227 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.402 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 1.6 mpt_? -75.2 -20.88 59.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.296 -175.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 25' ' ' LEU . 3.4 mm? -78.34 -15.73 58.42 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.109 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.454 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.0 -62.49 1.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -177.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.714 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -41.3 -48.12 4.55 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 114.845 -1.071 . . . . 0.0 114.475 169.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.3 m -66.97 -42.63 84.81 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.541 1.171 . . . . 0.0 111.794 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.01 -18.83 65.6 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 48' ' ' ALA . 46.3 mm -54.67 -40.25 50.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.277 175.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -118.6 77.15 1.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.024 177.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 t -125.28 -46.72 1.77 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.278 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 9' ' ' SER . 7.5 mp -66.77 -74.95 0.1 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.413 0.625 . . . . 0.0 111.743 -170.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.14 -3.22 54.41 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.326 0.584 . . . . 0.0 110.069 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.527 ' HA ' HG11 ' A' ' 61' ' ' VAL . 81.1 m -83.63 -35.99 24.2 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.354 173.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.1 mtpt -77.49 -15.52 59.25 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.056 172.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 tp -64.94 -66.41 0.55 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.529 172.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 22.2 t70 -176.22 121.26 0.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.5 p -179.47 43.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.622 0.725 . . . . 0.0 111.655 -176.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.576 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.3 m -105.97 121.46 58.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 110.366 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.666 ' HA ' HD22 ' A' ' 72' ' ' ASN . 1.8 t70 -64.55 -55.21 31.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.794 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.5 Cg_endo -97.72 -138.85 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.233 2.622 . . . . 0.0 113.298 -172.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -71.28 -5.51 32.79 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.226 -173.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 140.27 -56.75 0.61 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -170.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.6 p-10 -84.32 149.47 26.03 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.085 -0.557 . . . . 0.0 111.029 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.46 46.43 1.03 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.34 0.591 . . . . 0.0 110.799 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -75.14 81.42 2.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.534 0.683 . . . . 0.0 111.32 178.678 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -86.0 -63.25 1.35 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.232 -175.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.32 -60.27 8.88 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 121.278 -0.487 . . . . 0.0 113.05 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.666 HD22 ' HA ' ' A' ' 63' ' ' ASP . 13.9 m-20 -55.49 -29.04 58.06 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.29 -37.18 66.32 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.056 0.455 . . . . 0.0 110.919 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 78' ' ' MET . 72.6 mmtt -79.33 -33.67 42.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.04 -39.98 95.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.379 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.507 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 42.4 t80 -63.65 -32.51 74.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.396 177.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.71 -32.94 71.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.651 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 55.0 mtt -69.39 -28.12 65.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.859 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 76' ' ' PHE . 49.3 mtmt -86.31 -15.65 39.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.065 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -145.58 96.0 2.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.664 0.269 . . . . 0.0 111.199 -176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.08 -62.99 0.51 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.396 -0.906 . . . . 0.0 112.48 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -104.08 139.48 39.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.746 0.308 . . . . 0.0 111.032 -177.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.634 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -88.11 175.97 7.49 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.408 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -54.47 -38.36 66.3 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.747 -171.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.634 HG22 ' OD1' ' A' ' 83' ' ' ASP . 8.3 t -73.69 -25.09 60.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.497 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.753 ' HA ' HE21 ' A' ' 89' ' ' GLN . 54.0 mtt -84.62 -39.61 18.46 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.51 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -65.38 -39.26 92.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.352 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.452 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.61 -25.37 53.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.422 -174.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.753 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -83.1 -23.43 33.06 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.334 -0.547 . . . . 0.0 110.071 173.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.1 tt -82.97 -48.17 10.96 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.481 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -57.33 -36.19 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.883 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -65.77 -41.3 92.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.009 0.433 . . . . 0.0 110.568 -176.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.547 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.4 mp -62.46 -42.59 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.694 176.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 90' ' ' LEU . 34.2 mt -56.97 -48.13 82.16 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.152 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -67.0 -34.69 78.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.208 0.528 . . . . 0.0 110.233 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -48.81 5.57 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.705 -172.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 11.7 m -74.82 -31.45 61.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.734 -0.651 . . . . 0.0 112.669 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.586 ' CG ' HG11 ' A' ' 114' ' ' VAL . 37.5 mt-10 -57.36 -37.15 72.16 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.328 0.967 . . . . 0.0 109.833 166.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.79 -43.53 62.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.8 m -97.68 15.51 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.06 154.38 72.51 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.467 0.175 . . . . 0.0 110.573 177.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.42 ' HB2' ' OD1' ' A' ' 104' ' ' ASN . 13.8 Cg_exo -69.45 163.12 39.23 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.831 2.354 . . . . 0.0 110.939 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.44 40.72 0.29 Allowed 'Trans proline' 0 CA--C 1.534 0.515 0 C-N-CA 123.17 2.58 . . . . 0.0 113.379 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 102' ' ' PRO . 2.6 m-20 -83.07 93.69 7.65 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -81.57 94.48 6.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.984 0.421 . . . . 0.0 110.825 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.823 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 10.1 t70 -133.14 107.36 8.15 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -28.79 -58.74 0.13 Allowed 'General case' 0 N--CA 1.473 0.693 0 O-C-N 124.967 1.417 . . . . 0.0 114.59 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.22 -15.99 22.83 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.823 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 12.9 ttt -85.18 -25.49 27.36 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -167.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.17 -47.08 86.61 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.292 1.044 . . . . 0.0 110.741 -177.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.709 HG22 HD12 ' A' ' 112' ' ' ILE . 0.3 OUTLIER -53.94 -14.33 0.99 Allowed 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.29 174.308 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.714 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.6 mp -91.95 -41.68 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 1.0 OUTLIER -62.78 -32.43 73.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.735 176.644 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -80.39 -35.21 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 CA-C-O 121.211 0.529 . . . . 0.0 110.143 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.75 78.09 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.812 0.815 . . . . 0.0 111.557 174.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.715 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.57 -19.34 64.47 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.845 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.595 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 6.6 t -69.48 -30.32 68.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.105 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.537 ' HA ' HG12 ' A' ' 93' ' ' ILE . 62.9 t80 -70.99 -43.38 68.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.844 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 0.9 OUTLIER -69.35 -29.63 67.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.95 -1.1 . . . . 0.0 110.501 176.322 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.715 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -56.1 -47.88 77.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.413 0.625 . . . . 0.0 109.97 168.091 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.529 ' HG2' HD11 ' A' ' 93' ' ' ILE . 9.4 tp10 -57.09 -50.0 74.15 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.595 176.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -56.63 -31.26 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 120.629 0.252 . . . . 0.0 111.211 177.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.74 -32.09 67.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.66 ' O ' ' HD3' ' A' ' 124' ' ' LYS . 9.8 tmtt? -72.15 -27.9 62.9 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 92.8 mt . . . . . 0 CA--C 1.534 0.355 0 CA-C-N 115.135 -0.938 . . . . 0.0 111.976 179.384 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo . . . . . 0 CA--C 1.527 0.17 0 CA-C-O 120.715 0.214 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -46.48 -66.12 0.45 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.533 HD13 ' HB2' ' A' ' 82' ' ' ALA . 8.3 tp -81.3 -10.33 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.915 0.388 . . . . 0.0 111.56 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.35 -23.69 57.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.127 0.489 . . . . 0.0 110.037 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -91.12 114.92 27.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.273 172.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -62.35 138.79 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.964 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.18 -40.06 70.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.691 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 p -64.62 -34.85 79.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.144 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -71.58 -33.78 69.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.334 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.65 -53.87 24.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.549 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -46.67 -71.91 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.935 169.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.43 37.44 60.23 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.683 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -80.78 -49.72 10.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.152 0.501 . . . . 0.0 110.061 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -160.12 106.14 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.419 177.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 61.3 mtm -76.83 -21.15 55.47 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 175.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 32.0 t70 -58.8 -27.63 65.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.092 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.7 pt20 -84.07 -24.74 30.26 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.116 0.484 . . . . 0.0 109.884 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 63.5 m -73.45 -29.89 62.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 55.7 tptt -62.67 -53.42 54.72 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.721 177.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -69.69 -43.77 71.79 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.041 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -69.51 -41.18 76.4 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.293 -174.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 7.1 mt -82.07 -16.58 49.59 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.613 -177.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.0 m 57.79 43.31 22.06 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.596 HD23 HD12 ' A' ' 47' ' ' LEU . 50.1 mt -57.65 129.71 81.25 Favored Pre-proline 0 N--CA 1.468 0.433 0 CA-C-N 114.669 -1.151 . . . . 0.0 110.262 -175.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 20.6 Cg_exo -65.88 155.83 67.34 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 121.95 1.767 . . . . 0.0 110.449 173.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.85 -34.82 70.13 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.069 0.462 . . . . 0.0 111.032 -176.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 m -70.18 -42.1 72.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.235 -176.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.566 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.4 t -72.62 -53.85 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.63 -173.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.684 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.9 p -59.64 -30.64 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.177 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.87 -52.46 56.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.75 175.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.25 -38.1 68.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -176.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.684 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 2.4 pp -61.43 -32.56 72.53 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.742 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -64.67 8.18 0.13 Allowed 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 174.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -67.05 111.99 4.15 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.272 1.396 . . . . 0.0 111.011 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.31 -4.36 58.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.05 0.452 . . . . 0.0 110.56 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -90.03 145.29 25.19 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -83.31 58.53 4.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.437 0.637 . . . . 0.0 110.636 -178.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 5.5 t70 -42.6 -40.68 2.78 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.524 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 40.9 m-20 78.62 25.41 0.54 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.783 0.72 . . . . 0.0 111.155 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.43 175.82 9.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 0.0 110.957 178.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.32 124.56 52.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttm -78.84 92.74 4.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.049 0.452 . . . . 0.0 110.484 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 -30.91 13.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.71 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.39 135.14 48.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 122.005 0.907 . . . . 0.0 110.827 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.851 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 1.5 mpt_? -73.69 -30.94 63.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.845 -1.525 . . . . 0.0 109.919 -170.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.596 HD12 HD23 ' A' ' 25' ' ' LEU . 4.1 mm? -73.64 -15.63 61.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.032 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.88 -59.22 2.49 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.941 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -38.82 -47.07 2.35 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 115.361 -0.836 . . . . 0.0 114.057 166.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -66.5 -41.07 89.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.452 1.126 . . . . 0.0 111.752 177.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.9 -18.06 65.2 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.2 mm -56.78 -37.34 52.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.921 0.391 . . . . 0.0 110.671 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.422 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 60.3 t30 -141.08 86.59 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 0.0 110.307 178.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.7 p -106.82 -46.85 3.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.473 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -68.2 -44.98 74.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.086 -174.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.26 -13.32 58.61 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.9 0.381 . . . . 0.0 110.246 -174.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.672 ' HA ' HG11 ' A' ' 61' ' ' VAL . 91.3 m -79.05 -34.56 43.68 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.297 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -75.93 -20.93 57.58 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.433 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.5 mt -65.42 -66.19 0.58 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.482 175.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -177.19 116.59 0.1 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.672 HG11 ' HA ' ' A' ' 57' ' ' THR . 7.0 p -173.31 32.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 121.313 0.578 . . . . 0.0 111.52 -174.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.629 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 23.4 m -109.55 115.88 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 121.161 -0.962 . . . . 0.0 111.992 -175.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -74.51 -54.5 3.04 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.766 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.643 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 18.7 Cg_endo -99.15 -141.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 123.134 2.556 . . . . 0.0 113.246 -172.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.503 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 17.9 m-20 -75.45 10.1 1.84 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.668 -175.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.38 -75.32 0.42 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.206 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.691 HD22 HD23 ' A' ' 68' ' ' LEU . 2.2 p-10 -70.35 152.86 43.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.962 -0.619 . . . . 0.0 110.8 177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.691 HD23 HD22 ' A' ' 67' ' ' ASN . 3.9 mm? 69.13 34.81 2.92 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.574 0.546 . . . . 0.0 112.106 173.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 6.4 p-80 -73.31 77.53 1.34 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.738 0.78 . . . . 0.0 110.514 174.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -86.41 -61.71 1.68 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.746 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.94 56.21 Favored Glycine 0 CA--C 1.51 -0.275 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.444 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -58.71 -28.53 65.9 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.181 . . . . 0.0 111.44 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.566 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.23 -37.15 66.49 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.697 -0.627 . . . . 0.0 110.885 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.9 mmmt -81.03 -31.42 34.57 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.111 178.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.73 -40.31 95.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.327 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.415 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 64.2 t80 -62.98 -32.35 73.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.89 -38.62 79.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.69 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.569 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 66.0 mtm -69.26 -27.69 65.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.315 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.947 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -91.42 -12.44 34.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.46 179.266 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -141.33 90.98 2.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 O-C-N 122.183 -0.323 . . . . 0.0 111.042 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 109.55 -62.49 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.432 -0.89 . . . . 0.0 113.524 173.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.569 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.38 124.36 34.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.634 0.254 . . . . 0.0 110.912 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 4.6 p-10 -83.75 171.34 13.27 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.551 174.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -48.54 72.61 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.393 -164.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.775 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.0 t -61.0 -36.74 80.28 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.054 -173.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 50.4 mtm -81.01 -38.96 26.64 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.409 0.623 . . . . 0.0 109.5 -173.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.55 -39.64 84.65 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.165 173.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.49 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.32 -25.92 61.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.368 -177.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.775 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.1 mm-40 -77.99 -25.58 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 tp -88.13 -46.36 9.35 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.494 -176.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.4 m -56.92 -36.61 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.108 -173.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -65.73 -42.37 91.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.901 0.381 . . . . 0.0 110.579 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.576 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.6 mp -61.85 -38.88 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.041 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 47.1 mt -59.91 -45.79 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.209 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -68.51 -34.45 75.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.29 -49.68 5.13 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.47 -0.872 . . . . 0.0 112.244 -173.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 7.7 m -73.33 -31.23 63.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.563 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.765 ' HG3' HG11 ' A' ' 114' ' ' VAL . 18.8 mt-10 -65.29 -34.43 78.32 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.401 1.001 . . . . 0.0 110.271 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -64.81 -44.03 91.22 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.171 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.6 m -101.49 9.11 41.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -174.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -67.66 150.34 97.87 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.5 159.75 15.72 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 0.0 111.358 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.48 23.88 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.535 2.157 . . . . 0.0 113.078 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -94.71 91.92 6.75 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.48 95.98 7.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.558 0.694 . . . . 0.0 110.427 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.75 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.4 t70 -101.26 133.69 45.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.791 177.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -29.39 -72.32 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 O-C-N 125.327 1.642 . . . . 0.0 112.947 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.0 t -96.41 -21.79 17.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.851 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 59.1 ttp -77.39 -15.75 59.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.883 -0.51 . . . . 0.0 112.237 -168.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.428 ' CG ' ' H ' ' A' ' 111' ' ' THR . 12.1 ptmm? -56.27 -51.76 66.99 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 122.431 1.11 . . . . 0.0 109.355 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.428 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -60.18 -13.0 10.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.446 173.011 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.941 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -89.02 -40.58 13.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.29 -37.26 84.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.652 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.765 HG11 ' HG3' ' A' ' 98' ' ' GLU . 12.1 m -77.61 -35.67 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.885 178.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.27 76.55 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.17 0.51 . . . . 0.0 111.204 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.539 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 21.6 ptt? -69.79 -17.91 63.44 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.478 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.968 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 39.5 t -69.46 -32.78 71.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 122.143 0.973 . . . . 0.0 109.022 176.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -74.11 -38.11 63.93 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.93 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.589 ' HD2' ' C ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -67.66 -26.37 66.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 118.364 -1.334 . . . . 0.0 111.629 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.968 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -64.72 -56.36 14.19 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.539 -1.265 . . . . 0.0 109.354 172.05 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.0 -41.65 88.17 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.944 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -35.18 56.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.305 0.502 . . . . 0.0 110.697 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -72.06 -30.52 65.23 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 176.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -72.5 -33.71 67.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.121 0.486 . . . . 0.0 110.146 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 CA--C 1.536 0.429 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.412 171.284 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.435 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 82.1 Cg_endo . . . . . 0 N--CA 1.458 -0.58 0 N-CA-C 112.645 0.209 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -50.17 -70.61 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.903 0.752 . . . . 0.0 112.376 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.456 HD12 ' HB2' ' A' ' 82' ' ' ALA . 14.5 tt -87.2 -10.75 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.61 177.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.435 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 51.1 ttp -62.65 -40.76 98.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.469 0.652 . . . . 0.0 109.53 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -92.18 100.59 13.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.568 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 10' ' ' ASN . 57.2 m-80 -61.54 124.77 21.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.309 -172.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.12 -30.61 71.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.143 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 3.4 p -69.31 -35.34 75.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.577 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -72.4 -26.59 61.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.278 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.55 -40.01 84.98 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.507 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 33.0 m-85 -55.02 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.341 168.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.64 36.08 17.73 Favored Glycine 0 C--N 1.346 1.085 0 C-N-CA 121.108 -0.568 . . . . 0.0 113.747 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 2.2 tmmm? -65.88 -39.14 90.4 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.026 0.441 . . . . 0.0 110.58 -177.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.01 96.91 2.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.131 0.491 . . . . 0.0 111.498 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -80.14 -32.71 38.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -56.59 -40.49 75.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.307 -1.315 . . . . 0.0 111.693 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -88.12 -24.78 23.29 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.42 -169.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.2 t -73.37 -36.07 66.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 119.949 -0.7 . . . . 0.0 109.138 173.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 1.095 ' HA ' HD13 ' A' ' 25' ' ' LEU . 10.6 tptt -63.44 -39.29 94.09 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.643 0.735 . . . . 0.0 109.877 176.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -69.19 -40.92 77.76 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.651 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -71.46 -44.47 64.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.769 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 10.6 mt -86.35 -4.8 59.24 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.463 -175.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.3 t 63.3 34.26 13.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.509 176.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 1.095 HD13 ' HA ' ' A' ' 20' ' ' LYS . 6.4 mp -50.42 119.24 10.66 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.931 -176.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.0 Cg_exo -73.75 162.89 38.55 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.979 2.453 . . . . 0.0 111.655 174.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.624 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.4 p-10 -62.81 -29.67 70.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -174.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 t -68.18 -37.61 81.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.339 0.59 . . . . 0.0 110.03 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.926 HG21 HD23 ' A' ' 47' ' ' LEU . 41.5 t -75.45 -49.96 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.706 -177.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.624 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.6 m -55.91 -35.12 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.672 0.272 . . . . 0.0 110.749 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.57 69.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 0.0 111.632 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -68.43 -38.33 81.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.9 0.857 . . . . 0.0 109.17 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 3.1 tm? -55.76 -55.67 29.61 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.996 175.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -67.9 12.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.84 HD21 ' HB2' ' A' ' 39' ' ' ASP . 33.8 t30 -56.19 110.96 0.84 Allowed 'General case' 0 C--N 1.35 0.6 0 CA-C-N 120.051 1.296 . . . . 0.0 110.547 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -78.71 -27.86 45.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.679 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -88.3 157.77 18.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 -174.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.505 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 7.1 mptt -82.83 61.24 5.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.764 -175.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.84 ' HB2' HD21 ' A' ' 35' ' ' ASN . 1.0 OUTLIER -43.79 -48.21 8.12 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.628 176.108 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 68.19 19.68 9.06 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 118.258 0.481 . . . . 0.0 111.016 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.588 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -78.42 179.12 7.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.005 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 t -89.66 130.61 38.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.318 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 42.3 ttm -65.29 104.47 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.089 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.0 p -87.25 -40.62 14.36 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -173.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.514 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 6.2 t70 -90.64 117.48 29.33 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-O 122.284 1.04 . . . . 0.0 110.718 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.58 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.02 -38.45 62.38 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 113.161 -1.836 . . . . 0.0 112.242 175.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.926 HD23 HG21 ' A' ' 29' ' ' VAL . 46.5 tp -68.82 -18.18 64.13 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.939 0.399 . . . . 0.0 111.05 -174.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.7 -55.99 5.01 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.72 -45.37 1.48 Allowed Glycine 0 CA--C 1.533 1.159 0 CA-C-N 114.727 -1.124 . . . . 0.0 114.41 165.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 57.5 m -65.54 -43.41 90.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 118.09 0.945 . . . . 0.0 110.319 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -68.39 -25.45 65.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.776 -176.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.4 mt -77.24 -26.66 15.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 110.33 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.76 44.36 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 -45.18 2.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.5 -170.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 3.2 mm? -46.46 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.19 -15.49 53.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.811 0.338 . . . . 0.0 110.899 -172.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.421 HG23 HG11 ' A' ' 61' ' ' VAL . 1.5 m -78.62 -32.06 47.26 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.746 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.612 ' NZ ' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.52 -23.43 34.61 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.779 174.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 10.6 mt -63.38 -59.95 4.01 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 121.179 -0.209 . . . . 0.0 111.249 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -174.01 122.53 0.31 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -176.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HB3' ' A' ' 72' ' ' ASN . 9.8 p -177.11 33.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 121.59 0.71 . . . . 0.0 111.142 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.651 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 35.5 m -98.3 114.07 34.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 O-C-N 121.25 -0.907 . . . . 0.0 110.579 -176.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -56.75 4.1 Favored Pre-proline 0 CA--C 1.53 0.198 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.237 -176.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.585 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 4.4 Cg_endo -91.81 -144.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.815 2.343 . . . . 0.0 112.715 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -74.64 10.5 1.34 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.371 -176.393 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.01 -75.55 0.31 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.572 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.691 HD22 HD23 ' A' ' 68' ' ' LEU . 1.2 p-10 -75.06 168.61 19.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.051 -0.575 . . . . 0.0 111.075 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.691 HD23 HD22 ' A' ' 67' ' ' ASN . 3.6 mm? 70.12 28.62 3.99 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 123.76 0.663 . . . . 0.0 111.952 173.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 7.9 p80 -76.83 65.9 2.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.402 0.62 . . . . 0.0 110.832 172.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -88.9 -49.75 6.61 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.138 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.11 -51.86 54.84 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.502 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.434 ' HB3' HG22 ' A' ' 61' ' ' VAL . 1.6 t-20 -59.24 -35.65 74.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.72 -0.24 . . . . 0.0 111.512 -176.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.86 -37.07 70.28 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.1 0.476 . . . . 0.0 111.068 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.606 ' O ' ' HG3' ' A' ' 78' ' ' MET . 5.2 mmmp? -80.64 -36.14 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.828 -178.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.489 ' HA ' ' HE2' ' A' ' 78' ' ' MET . 26.0 t70 -65.58 -41.04 93.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -60.63 -37.8 82.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.088 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.79 71.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.298 178.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.1 mtm -74.36 -34.96 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.797 0.332 . . . . 0.0 111.803 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -93.88 -8.42 40.34 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.93 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -141.89 88.53 2.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.72 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.17 -74.79 0.43 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.424 -0.893 . . . . 0.0 112.621 177.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.532 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -107.66 141.13 39.64 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 165.63 23.77 Favored 'General case' 0 CA--C 1.489 -1.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 11.2 pt-20 -67.49 -21.39 65.51 Favored 'General case' 0 N--CA 1.409 -2.484 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.628 -164.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.71 -28.2 63.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.643 -179.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.697 ' HA ' HE21 ' A' ' 89' ' ' GLN . 38.8 mtt -83.74 -39.76 19.69 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.578 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.59 -37.74 87.51 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.718 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.71 -27.01 50.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.8 -174.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.697 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.9 pt20 -79.96 -24.19 41.15 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.209 172.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.492 ' O ' HG13 ' A' ' 94' ' ' ILE . 25.6 tp -81.41 -46.15 15.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.13 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 87' ' ' ALA . 17.7 m -57.57 -33.32 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.959 -175.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.77 -45.16 87.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.326 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.66 -40.0 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 91' ' ' VAL . 74.2 mt -54.43 -50.05 60.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.275 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -71.76 -33.41 68.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.645 -174.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.1 -49.55 5.53 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.684 -174.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 114' ' ' VAL . 0.1 OUTLIER -72.63 -28.59 62.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.796 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.51 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.9 tt0 -62.33 -38.62 90.15 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.672 0.273 . . . . 0.0 111.405 170.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -67.43 -33.69 75.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.893 0.378 . . . . 0.0 110.481 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.5 m -96.38 8.76 43.2 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.279 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.61 155.59 87.22 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.705 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 92.2 Cg_exo -45.08 140.59 7.25 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.159 2.573 . . . . 0.0 112.425 176.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.8 Cg_exo -69.59 24.81 0.17 Allowed 'Trans proline' 0 N--CA 1.476 0.469 0 C-N-CA 123.695 2.93 . . . . 0.0 113.703 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' A' ' 102' ' ' PRO . 89.3 m-20 -109.04 93.95 4.78 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -76.46 95.13 3.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.654 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.7 t70 -121.2 124.42 44.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.275 172.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.581 ' HD2' ' H ' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -33.81 -51.31 0.39 Allowed 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -178.346 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.581 ' H ' ' HD2' ' A' ' 107' ' ' LYS . 91.4 m -92.4 -30.71 15.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.654 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 62.6 mmm -61.67 -46.08 91.27 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 122.1 0.953 . . . . 0.0 110.162 -176.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.68 ' O ' HG13 ' A' ' 114' ' ' VAL . 15.8 ptmt -66.09 -50.56 63.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.485 -178.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -58.66 -15.33 11.28 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.27 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.5 mp -89.16 -39.67 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -38.97 87.44 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.188 174.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 110' ' ' LYS . 2.8 m -80.13 -39.33 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 121.497 0.665 . . . . 0.0 110.11 -173.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.78 -41.39 99.23 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.03 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.659 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -67.33 -24.52 65.74 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.49 -177.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 86.6 m -66.63 -30.74 71.08 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.183 0.516 . . . . 0.0 109.943 174.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -70.07 -40.64 74.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.246 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.5 OUTLIER -68.49 -20.4 64.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.898 177.366 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.659 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.84 -49.26 71.29 Favored 'General case' 0 C--N 1.342 0.28 0 O-C-N 121.815 -0.553 . . . . 0.0 109.559 168.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 10.1 mm-40 -58.7 -50.84 72.38 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.165 176.139 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.512 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -54.12 -36.12 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 117.629 0.195 . . . . 0.0 111.24 178.725 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -70.55 -32.65 70.16 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -68.87 -35.6 77.1 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 110.079 175.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 72.1 mt . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.6 174.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.863 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 19.0 Cg_endo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 113.95 0.712 . . . . 0.0 113.95 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.3 mp0 -45.03 -67.56 0.27 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.389 0.43 . . . . 0.0 111.281 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.718 HD13 ' HB2' ' A' ' 82' ' ' ALA . 9.3 tp -87.68 -11.04 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.84 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.863 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.9 mtp -72.9 -21.44 60.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.957 0.408 . . . . 0.0 110.947 -178.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -86.7 81.14 8.32 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 171.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.628 HD21 HG13 ' A' ' 52' ' ' ILE . 3.8 m-20 -61.75 130.39 45.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.886 -176.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.488 HD23 HD22 ' A' ' 11' ' ' ASN . 84.7 mt -58.3 -33.78 69.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.51 -178.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.4 t -62.03 -39.41 92.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 109.956 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -76.13 -31.16 58.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.787 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.488 HD22 HD23 ' A' ' 8' ' ' LEU . 87.0 m-20 -67.92 -49.55 61.23 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -48.26 -74.2 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.942 170.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 52.66 35.59 46.32 Favored Glycine 0 C--N 1.344 0.981 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.477 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -73.95 -37.51 64.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 121.053 0.454 . . . . 0.0 110.319 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.476 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.52 104.36 4.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.525 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 53.2 ttm -81.16 -32.29 33.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.241 0.544 . . . . 0.0 109.569 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.8 -33.0 68.1 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.7 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -88.1 -25.01 23.23 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.076 -0.65 . . . . 0.0 111.362 -173.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.45 -34.95 70.71 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -63.68 -48.1 78.55 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.374 0.607 . . . . 0.0 110.205 176.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.4 -47.6 60.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.465 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 2.8 tp10 -69.51 -35.14 75.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.451 0.167 . . . . 0.0 111.349 -173.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.662 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 3.9 mm? -77.31 -22.19 52.32 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 120.939 0.4 . . . . 0.0 110.423 176.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.1 m 58.55 41.52 22.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.53 -169.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CB ' ' A' ' 23' ' ' LEU . 55.9 mt -65.68 139.43 97.03 Favored Pre-proline 0 CA--C 1.516 -0.342 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.861 -172.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.577 ' HG2' HG23 ' A' ' 29' ' ' VAL . 75.1 Cg_endo -82.24 163.64 17.37 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.734 2.289 . . . . 0.0 110.259 170.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.82 -33.44 75.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.757 0.313 . . . . 0.0 111.17 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.2 p -67.89 -47.36 69.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 -178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.577 HG23 ' HG2' ' A' ' 26' ' ' PRO . 65.1 t -73.43 -46.94 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.377 -173.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.51 -32.2 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 118.743 0.701 . . . . 0.0 110.634 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.44 -52.01 37.45 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.806 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -66.84 -33.92 76.67 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.6 tp -49.43 -53.98 19.95 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.931 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -65.58 11.89 0.06 Allowed 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.75 98.91 0.21 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.813 1.642 . . . . 0.0 109.789 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -73.5 -20.83 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.129 -174.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -76.76 147.41 37.31 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -76.08 67.52 2.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.863 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.653 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 3.1 t70 -43.44 -52.23 6.14 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.601 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.416 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 26.9 t70 73.19 20.41 3.34 Favored 'General case' 0 C--N 1.355 0.842 0 CA-C-O 122.243 1.021 . . . . 0.0 109.583 -177.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.653 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -85.17 177.97 7.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.359 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.8 t -89.84 126.69 42.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.942 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.8 ttm -71.66 103.43 3.04 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.28 -40.95 17.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.18 -172.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.485 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.0 t70 -89.06 116.63 27.47 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.771 0.796 . . . . 0.0 110.316 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.734 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -54.12 -37.13 64.01 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.901 -1.499 . . . . 0.0 112.257 176.239 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.576 HD21 ' HD3' ' A' ' 26' ' ' PRO . 27.9 tp -66.54 -15.25 63.26 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.286 0.565 . . . . 0.0 110.813 -174.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.31 -51.6 8.7 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.807 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.34 -45.76 3.34 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.004 -0.998 . . . . 0.0 114.366 165.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.509 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 4.0 m -62.0 -46.35 89.61 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.621 1.21 . . . . 0.0 110.061 177.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB2' ' HG ' ' A' ' 23' ' ' LEU . . . -80.28 1.74 27.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.006 -175.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 7' ' ' ASN . 1.9 tp -62.54 -26.91 41.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 173.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 62.9 t30 -147.32 86.07 1.61 Allowed 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.394 174.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.435 ' HB3' HD21 ' A' ' 23' ' ' LEU . 16.3 p -101.75 -45.28 5.28 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.524 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.523 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 mt -70.24 -44.48 68.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 0.0 111.49 -173.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.414 ' HB3' ' OD1' ' A' ' 53' ' ' ASN . . . -80.67 -13.2 59.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 -175.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.595 ' HA ' HG11 ' A' ' 61' ' ' VAL . 98.9 m -83.09 -36.75 24.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.164 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.439 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 25.0 mtpp -71.52 -21.43 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.56 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 53.4 mt -65.35 -65.67 0.64 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.373 175.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -175.45 113.11 0.13 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.314 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.595 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.0 p -175.38 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.594 0.712 . . . . 0.0 111.408 -177.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.705 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.4 m -103.66 120.9 54.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 120.888 -1.132 . . . . 0.0 111.088 -177.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.33 -56.18 5.51 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.74 177.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.0 Cg_endo -97.06 -139.21 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.228 2.619 . . . . 0.0 112.761 -171.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.421 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 65.0 m-20 -75.67 11.94 1.19 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.404 -173.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.32 -71.6 0.5 Allowed Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -174.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.619 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p-10 -77.51 156.03 31.26 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.824 -0.688 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.75 41.39 1.21 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.382 0.611 . . . . 0.0 111.833 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.705 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 5.5 p80 -78.25 80.11 4.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.15 177.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -86.88 -62.59 1.47 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.055 -178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.07 -54.75 35.43 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.685 -177.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -56.08 -34.66 66.18 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.626 0.251 . . . . 0.0 111.347 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.531 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -66.91 -35.78 80.78 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.246 0.545 . . . . 0.0 111.006 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.57 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.5 mmmt -79.79 -40.01 29.58 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.316 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.59 -39.73 94.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.812 0.339 . . . . 0.0 110.276 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -57.88 -40.85 81.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.541 175.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.04 78.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.716 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.57 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 56.2 mtt -69.93 -39.45 76.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.001 0.429 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -89.08 -9.34 51.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.96 0.409 . . . . 0.0 110.556 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -143.69 91.24 2.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.411 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 118.3 -76.43 0.29 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.565 175.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.718 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.04 137.02 33.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.653 0.264 . . . . 0.0 110.697 -176.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -79.2 154.96 28.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 121.369 0.604 . . . . 0.0 109.762 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -63.39 -43.83 96.46 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.985 -167.162 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.572 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 2.8 m -51.57 -45.68 63.19 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.863 174.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 2.7 ptm -76.32 -39.33 54.35 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.413 0.625 . . . . 0.0 109.419 -177.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -61.03 -36.38 79.38 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.02 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.734 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.7 mp0 -70.8 -25.27 62.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.976 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.4 mm-40 -78.08 -24.46 47.63 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.528 ' O ' HG13 ' A' ' 94' ' ' ILE . 23.4 tp -87.23 -46.16 9.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.683 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' A' ' 88' ' ' GLN . 5.2 m -60.89 -28.51 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -44.17 93.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.65 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.8 mp -67.52 -41.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.118 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 90' ' ' LEU . 54.5 mt -57.5 -46.95 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.247 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -70.14 -33.85 72.32 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.418 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -54.93 3.23 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.151 -1.023 . . . . 0.0 112.263 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.0 m -72.97 -31.39 64.5 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.434 ' HB2' HG11 ' A' ' 114' ' ' VAL . 42.3 tt0 -68.13 -36.39 79.63 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.456 1.025 . . . . 0.0 110.789 171.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' A' ' 99' ' ' LYS . 23.9 ttpp -64.27 -43.21 95.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.918 0.39 . . . . 0.0 110.858 177.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 m -104.1 25.53 9.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.25 155.42 92.36 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.297 178.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 50.8 Cg_exo -53.7 155.23 14.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.594 2.196 . . . . 0.0 111.699 176.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 15.1 Cg_exo -70.22 24.64 0.19 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.232 2.621 . . . . 0.0 113.191 -177.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 102' ' ' PRO . 85.2 m-20 -105.4 93.37 4.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -79.5 95.43 5.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.816 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.3 t0 -105.56 120.39 41.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.077 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -29.03 -73.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 O-C-N 125.312 1.633 . . . . 0.0 113.689 -176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.488 ' O ' HG22 ' A' ' 111' ' ' THR . 18.0 t -97.68 -7.26 31.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.816 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.4 ttt -82.56 -28.2 31.1 Favored 'General case' 0 C--O 1.251 1.134 0 O-C-N 121.417 -0.802 . . . . 0.0 113.005 -168.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.662 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.2 OUTLIER -56.94 -45.15 82.96 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.929 0.871 . . . . 0.0 110.736 -173.125 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.662 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.6 t -58.87 -10.59 2.53 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 0.0 113.126 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.807 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -91.5 -39.56 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -58.23 -38.87 77.7 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.222 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.654 HG22 ' HA ' ' A' ' 111' ' ' THR . 6.3 m -84.88 -31.38 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 CA-C-O 121.416 0.627 . . . . 0.0 110.041 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.12 -46.35 90.93 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.246 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.557 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.3 ptt? -67.95 -20.45 65.06 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.111 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.917 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 21.4 t -68.69 -30.26 68.89 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.482 0.658 . . . . 0.0 109.263 174.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.65 ' HA ' HG12 ' A' ' 93' ' ' ILE . 71.6 t80 -77.16 -49.37 15.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.298 -178.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.516 ' HE3' ' C ' ' A' ' 119' ' ' LYS 0.254 0.0 OUTLIER -70.96 -16.55 62.66 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.072 177.757 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.917 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -62.26 -54.38 41.61 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.303 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -58.72 -48.96 79.36 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.343 174.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -33.99 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 122.002 -0.436 . . . . 0.0 111.326 178.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -71.98 -31.61 66.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.96 -0.463 . . . . 0.0 111.767 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -66.6 -37.44 84.9 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.924 0.392 . . . . 0.0 110.527 175.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 70.2 mt . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.848 172.32 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.649 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 13.0 Cg_endo . . . . . 0 CA--C 1.529 0.256 0 N-CA-C 112.8 0.269 . . . . 0.0 112.8 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -54.04 -69.7 0.12 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.127 174.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 tp -73.91 -13.43 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 110.926 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.649 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.3 ttt -72.39 -29.97 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.059 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -81.52 96.84 7.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.44 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.461 HD21 HG23 ' A' ' 52' ' ' ILE . 25.8 t-20 -66.55 128.46 36.3 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.499 HD11 ' O ' ' A' ' 80' ' ' HIS . 22.2 mt -54.94 -45.64 74.88 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -176.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -66.12 -35.51 80.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.453 0.168 . . . . 0.0 110.914 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -70.45 -36.68 74.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.136 0.493 . . . . 0.0 110.482 177.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -67.3 -55.36 14.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.907 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 31.2 m-85 -50.41 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.49 -0.777 . . . . 0.0 113.036 173.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.06 35.69 54.78 Favored Glycine 0 C--N 1.342 0.911 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.188 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 9.0 tmtt? -85.44 -36.81 20.39 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.985 0.422 . . . . 0.0 110.155 -176.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.55 88.38 2.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.28 0.562 . . . . 0.0 110.873 -176.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.6 mtm -82.53 -45.62 14.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.051 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -60.24 -44.61 95.1 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.119 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 3.7 mm100 -87.23 -21.05 26.08 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.279 -171.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -75.72 -31.9 59.83 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 170.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 25' ' ' LEU . 27.5 tptp -57.8 -55.39 35.51 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.49 178.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -73.85 -39.57 63.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.09 -177.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 19.1 tt0 -70.35 -32.73 70.56 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -172.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.485 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -83.8 -1.16 53.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.019 0.438 . . . . 0.0 110.08 178.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t 63.81 29.06 14.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.901 -177.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.669 HD21 ' HB2' ' A' ' 51' ' ' ALA . 21.3 mt -70.62 128.34 91.11 Favored Pre-proline 0 N--CA 1.45 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.521 -172.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 57.6 Cg_endo -79.76 151.92 22.11 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 121.798 1.666 . . . . 0.0 108.847 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -31.83 66.31 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.871 -176.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 p -65.06 -52.81 53.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.653 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.571 HG23 ' HG2' ' A' ' 26' ' ' PRO . 90.0 t -69.5 -50.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -175.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.556 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.6 p -61.18 -32.75 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.827 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.05 -46.67 50.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.953 0.406 . . . . 0.0 111.12 177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.28 -38.25 88.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.182 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.578 HD13 ' HB1' ' A' ' 48' ' ' ALA . 23.4 tp -55.7 -56.86 15.47 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.855 171.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -68.59 11.64 0.17 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -52.12 125.44 15.68 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 120.24 1.382 . . . . 0.0 110.223 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -70.21 -33.68 71.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.631 -175.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -90.5 142.91 27.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.561 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -75.8 78.21 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.42 0.629 . . . . 0.0 110.918 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -42.83 -46.72 5.36 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.759 173.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 70.42 32.25 2.78 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.835 0.826 . . . . 0.0 110.112 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.28 175.69 9.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.836 175.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.0 t -90.95 127.3 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 169.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.9 ttm -69.31 94.38 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.181 0.515 . . . . 0.0 109.797 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 p -85.01 -36.26 21.4 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.141 -174.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.542 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.8 t70 -87.04 117.0 25.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.754 0.788 . . . . 0.0 110.597 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.63 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.39 -37.5 62.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.354 175.612 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.664 HD21 ' HD3' ' A' ' 26' ' ' PRO . 33.4 tp -68.92 -14.87 63.3 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.234 0.54 . . . . 0.0 111.013 -172.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.578 ' HB1' HD13 ' A' ' 33' ' ' LEU . . . -76.74 -54.83 6.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.94 -47.17 1.85 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.505 166.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 5.9 m -63.16 -45.02 93.83 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.242 1.021 . . . . 0.0 110.645 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.669 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -72.34 -11.41 60.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.276 -176.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.461 HG23 HD21 ' A' ' 7' ' ' ASN . 67.6 mt -58.67 -39.03 74.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 109.846 173.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.58 84.81 2.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.597 0.713 . . . . 0.0 110.425 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -116.32 -48.26 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.751 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.32 -48.29 23.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 111.484 -172.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HB1' ' HZ ' ' A' ' 76' ' ' PHE . . . -81.01 -15.61 55.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.366 0.603 . . . . 0.0 109.958 -174.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.783 HG23 HG11 ' A' ' 61' ' ' VAL . 55.4 m -80.71 -35.89 32.91 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.267 174.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -71.8 -22.46 61.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -63.67 -64.04 1.01 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.059 175.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -175.24 119.86 0.19 Allowed 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.783 HG11 HG23 ' A' ' 57' ' ' THR . 10.4 p -171.11 32.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.645 0.736 . . . . 0.0 111.096 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.627 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 1.3 m -108.12 122.08 62.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.037 -1.04 . . . . 0.0 111.2 -175.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -53.58 2.77 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.013 177.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.649 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 22.7 Cg_endo -99.72 -139.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.08 2.52 . . . . 0.0 113.326 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.5 t70 -72.9 10.67 0.83 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.477 -173.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.75 -67.84 0.55 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.203 -0.998 . . . . 0.0 111.523 -173.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.728 HD22 HD23 ' A' ' 68' ' ' LEU . 2.8 p-10 -82.37 154.93 24.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.95 -0.625 . . . . 0.0 111.243 -178.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.728 HD23 HD22 ' A' ' 67' ' ' ASN . 4.4 mm? 69.32 38.57 1.82 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.228 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.627 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 14.3 p80 -75.78 81.06 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.371 0.605 . . . . 0.0 111.233 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -86.41 -61.67 1.69 Allowed 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.744 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.97 -56.37 25.11 Favored Glycine 0 CA--C 1.508 -0.378 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.79 -175.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -55.49 -29.63 59.14 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 123.712 0.301 . . . . 0.0 111.44 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.565 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.74 -36.51 65.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.36 0.6 . . . . 0.0 111.235 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.588 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.2 mmmt -79.18 -39.8 32.46 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . 0.439 ' O ' ' HD2' ' A' ' 79' ' ' LYS . 21.4 t70 -60.7 -41.02 94.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.976 174.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HZ ' ' HB1' ' A' ' 56' ' ' ALA . 54.3 t80 -56.44 -42.78 78.68 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.084 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.37 -25.19 63.15 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.483 -0.487 . . . . 0.0 111.264 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.588 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 48.4 mtt -68.39 -39.48 81.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.357 178.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HD2' ' O ' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -93.41 -7.84 43.46 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.466 178.001 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.499 ' O ' HD11 ' A' ' 8' ' ' LEU . 43.9 m-70 -134.71 89.21 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.711 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 123.32 -68.65 0.47 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.329 -0.939 . . . . 0.0 112.9 171.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.1 150.48 20.79 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.032 0.444 . . . . 0.0 111.478 -175.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.63 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 5.5 m-20 -76.66 151.22 36.24 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.11 -32.69 69.34 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.151 -168.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.26 -28.63 65.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.848 174.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 20.1 mtm -88.24 -41.59 12.84 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.592 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.82 -39.24 80.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.442 171.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.516 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -74.85 -27.16 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 122.642 0.377 . . . . 0.0 111.776 -175.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.0 pt20 -80.99 -22.81 39.18 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.589 172.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -83.42 -42.19 17.25 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.911 -179.149 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.6 m -57.59 -32.47 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -45.12 95.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.158 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.622 HG23 ' SG ' ' A' ' 117' ' ' CYS . 3.3 mm -65.84 -44.16 92.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.53 174.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.5 mt -52.72 -47.8 50.04 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.771 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -70.19 -34.75 73.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.424 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.52 -52.36 3.98 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.59 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.6 m -72.29 -32.19 66.39 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.924 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.543 ' HB2' HG11 ' A' ' 114' ' ' VAL . 34.0 tt0 -67.86 -38.41 83.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.959 0.8 . . . . 0.0 110.411 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.62 -43.54 89.24 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.941 0.4 . . . . 0.0 110.49 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -96.01 16.99 16.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.046 -176.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.39 151.42 91.93 Favored Pre-proline 0 C--N 1.325 -0.48 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.445 ' C ' ' H ' ' A' ' 104' ' ' ASN . 52.5 Cg_exo -53.51 156.64 10.85 Favored 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 122.779 2.319 . . . . 0.0 112.156 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.07 24.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.062 2.508 . . . . 0.0 113.265 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 102' ' ' PRO . 67.5 m-20 -90.17 93.91 9.55 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -80.94 96.55 7.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.05 -177.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.916 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 11.9 t70 -122.32 105.87 10.58 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -29.26 -58.49 0.15 Allowed 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.954 1.409 . . . . 0.0 114.116 -177.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.8 t -93.98 -12.69 28.16 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.89 -0.506 . . . . 0.0 112.246 -173.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.916 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.3 ttt -85.7 -27.62 25.19 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.777 0.799 . . . . 0.0 111.617 -169.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.14 -39.15 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.257 -177.433 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -16.82 9.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.685 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.588 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.8 mp -87.73 -36.0 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.86 -36.2 74.22 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.781 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.543 HG11 ' HB2' ' A' ' 98' ' ' GLU . 8.5 m -80.21 -38.35 18.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 O-C-N 121.919 -0.488 . . . . 0.0 110.758 177.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.89 -46.92 88.71 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.864 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.797 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.18 -21.02 60.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.775 178.219 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.622 ' SG ' HG23 ' A' ' 93' ' ' ILE . 11.2 t -66.92 -28.68 68.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 0.0 109.804 171.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -81.04 -48.16 12.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.916 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.797 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.1 -29.25 66.17 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 118.473 -1.291 . . . . 0.0 110.404 -179.873 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 116' ' ' MET . 11.0 ttmt -55.4 -54.85 38.63 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.24 170.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 19.9 mm-40 -57.76 -51.59 68.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.609 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.8 tt -59.33 -33.16 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 118.034 0.379 . . . . 0.0 111.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -71.96 -30.72 65.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.314 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -74.13 -35.84 64.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.072 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.626 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 96.9 Cg_endo . . . . . 0 N--CA 1.462 -0.351 0 N-CA-C 113.206 0.425 . . . . 0.0 113.206 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -50.11 -69.2 0.12 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.622 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.6 tp -73.45 -10.89 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.38 0.609 . . . . 0.0 111.101 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.626 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 77.0 mtp -79.31 -21.71 45.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.552 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -81.1 80.98 7.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.203 0.525 . . . . 0.0 109.601 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -62.12 134.09 56.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.356 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.0 mp -54.9 -45.86 74.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.807 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -63.9 -32.63 74.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.84 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -74.98 -35.97 62.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.147 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.93 -45.91 69.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.02 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -46.76 -77.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.565 170.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.09 38.66 32.53 Favored Glycine 0 C--N 1.342 0.884 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.173 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -63.81 -55.56 22.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.021 0.439 . . . . 0.0 110.613 -177.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.5 105.37 4.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -70.52 -37.15 74.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.711 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.74 -28.74 69.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.511 -178.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 17.8 mm-40 -88.66 -27.18 21.44 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.226 -173.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 t -74.51 -35.02 63.17 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 1.026 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -59.32 -51.28 70.63 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.425 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -73.76 -32.31 63.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.406 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -68.16 -44.82 75.1 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.633 0.254 . . . . 0.0 110.844 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.687 ' HB2' HD22 ' A' ' 25' ' ' LEU . 10.5 mt -83.43 -17.29 42.65 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.042 0.449 . . . . 0.0 110.677 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.0 t 66.05 37.97 5.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.587 -177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 1.026 HD23 ' HA ' ' A' ' 20' ' ' LYS . 2.2 mm? -51.04 135.75 28.72 Favored Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.139 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.9 Cg_exo -65.28 149.65 88.25 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.909 1.739 . . . . 0.0 109.504 166.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -60.13 -32.66 71.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.673 0.273 . . . . 0.0 111.017 -174.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 t -70.01 -40.54 75.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.907 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 43.7 t -71.44 -53.14 21.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.392 -176.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.712 HG21 ' HG2' ' A' ' 20' ' ' LYS . 9.9 p -60.34 -36.51 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.804 -178.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.34 -51.52 56.4 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.205 177.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -37.85 88.94 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.229 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.5 tp -54.36 -56.62 16.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.796 173.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -68.97 11.66 0.19 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -59.13 130.55 47.51 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 119.926 1.239 . . . . 0.0 110.12 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -70.34 -35.02 73.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.794 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -84.44 136.98 33.62 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.559 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 3.3 mptp? -85.24 75.21 10.31 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.891 -171.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 17.4 t70 -44.04 -55.38 4.73 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.291 172.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.9 t70 75.28 35.5 0.57 Allowed 'General case' 0 C--N 1.348 0.529 0 CA-C-O 121.899 0.857 . . . . 0.0 110.386 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.483 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -77.67 178.01 7.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.828 175.804 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.9 t -84.61 114.8 25.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 174.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.7 ttm -66.71 102.22 0.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.833 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -99.44 -34.8 10.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.104 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.88 117.32 11.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.928 0.87 . . . . 0.0 110.791 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.712 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -47.94 -36.91 13.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.695 -1.593 . . . . 0.0 112.718 174.439 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 25' ' ' LEU . 3.3 mm? -68.5 -20.25 64.57 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.533 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.68 -55.6 4.72 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.27 -43.15 1.4 Allowed Glycine 0 CA--C 1.534 1.232 0 CA-C-N 115.021 -0.99 . . . . 0.0 114.629 167.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.429 ' HB3' HD13 ' A' ' 23' ' ' LEU . 3.2 m -79.61 -43.96 21.89 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.656 1.228 . . . . 0.0 112.174 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.53 ' HB2' HD11 ' A' ' 25' ' ' LEU . . . -71.08 -23.45 62.12 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 tp -73.12 -25.2 21.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.943 0.401 . . . . 0.0 110.305 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.5 43.63 3.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.24 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.6 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 30.7 p -94.55 -44.51 7.82 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.58 -177.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.409 ' O ' HD23 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.88 -46.86 88.93 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -171.019 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.77 -12.27 59.79 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.228 -174.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.541 HG23 HG11 ' A' ' 61' ' ' VAL . 89.4 m -83.75 -33.83 24.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.482 174.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 18.6 mmmt -75.08 -23.93 58.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.636 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.4 mm? -64.96 -65.14 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.054 174.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -177.41 116.68 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 -178.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.541 HG11 HG23 ' A' ' 57' ' ' THR . 12.7 p -167.3 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 122.133 0.968 . . . . 0.0 110.113 -177.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.654 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.3 m -107.59 116.89 52.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.419 -177.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -55.08 5.39 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.301 177.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 1.2 Cg_endo -91.17 -147.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.078 2.519 . . . . 0.0 112.605 -175.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -74.35 2.76 8.61 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -173.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 148.19 -61.35 0.44 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.303 -177.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 0.3 OUTLIER -87.87 164.17 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.509 -178.475 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 68' ' ' LEU . 0.4 OUTLIER 69.07 28.69 4.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 173.171 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.654 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.0 p80 -80.3 67.87 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.809 -0.557 . . . . 0.0 111.648 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -87.57 -48.43 7.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 110.085 176.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.54 -51.98 54.58 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.153 -176.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.42 -32.7 71.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.716 -0.242 . . . . 0.0 111.3 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.476 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -64.88 -36.07 83.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE3' HG12 ' A' ' 91' ' ' VAL . 4.4 mmmp? -79.74 -36.35 37.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.449 178.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.03 -40.96 95.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.345 176.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -63.57 -37.2 86.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.165 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -34.36 73.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.241 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.501 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.8 mtm -74.4 -35.78 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.13 -9.21 46.38 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.52 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.534 ' HB3' HD21 ' A' ' 8' ' ' LEU . 57.1 m-70 -141.07 89.27 2.23 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.687 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.19 -75.12 0.36 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.864 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.96 142.88 28.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.952 0.406 . . . . 0.0 111.63 -174.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.596 ' OD2' HG22 ' A' ' 85' ' ' THR . 2.3 p-10 -77.95 159.54 28.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 170.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -61.81 -42.31 98.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.132 -162.134 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.596 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.6 t -54.13 -27.92 36.45 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.85 177.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.623 ' HA ' ' HG2' ' A' ' 89' ' ' GLN . 75.7 mtp -85.28 -39.58 17.56 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.449 0.642 . . . . 0.0 109.909 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.666 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.78 -31.83 73.03 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.947 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -82.24 -26.39 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.051 -176.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 26.1 pt20 -78.22 -22.89 47.81 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.6 tp -75.01 -47.25 30.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.974 175.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.666 HG13 ' O ' ' A' ' 87' ' ' ALA . 32.0 m -57.9 -35.81 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 120.857 0.361 . . . . 0.0 111.44 -176.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -62.69 -43.93 97.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.521 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.28 -42.71 84.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.19 176.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 90' ' ' LEU . 55.9 mt -56.01 -48.14 79.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.122 0.487 . . . . 0.0 110.457 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.961 -175.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.56 -44.88 6.31 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.052 -172.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.9 m -73.09 -41.7 63.79 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 119.321 -0.371 . . . . 0.0 111.35 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 101' ' ' ALA . 4.0 tt0 -66.38 -29.48 69.66 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.982 173.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -63.71 -39.82 95.25 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.219 0.533 . . . . 0.0 109.951 173.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.7 m -99.58 15.93 24.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.001 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.413 ' HB2' ' HA ' ' A' ' 98' ' ' GLU . . . -77.45 147.73 75.99 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.272 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 70.3 Cg_exo -52.79 151.89 18.63 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.257 2.638 . . . . 0.0 112.606 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 13.9 Cg_exo -70.84 47.1 0.69 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.719 2.946 . . . . 0.0 112.907 -179.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -125.57 94.3 4.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.369 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -81.54 96.5 7.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.101 0.476 . . . . 0.0 111.74 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.517 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 11.6 t70 -112.84 113.81 26.06 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 168.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.579 ' HG2' ' H ' ' A' ' 108' ' ' CYS . 0.9 OUTLIER -33.63 -60.55 0.36 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 107' ' ' LYS . 5.9 t -91.19 -12.08 36.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.824 0.738 . . . . 0.0 112.16 -175.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 46' ' ' ARG . 2.9 ttp -81.29 -29.96 34.13 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-O 122.025 0.917 . . . . 0.0 111.525 -171.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.423 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.31 -39.11 78.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.565 -179.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -15.81 3.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.508 -1.224 . . . . 0.0 112.428 174.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.53 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -90.69 -38.57 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.3 OUTLIER -58.31 -38.26 76.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.056 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.589 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -80.86 -35.92 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.525 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.31 81.58 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.63 ' HA ' ' HD2' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.52 -19.91 60.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.608 0.718 . . . . 0.0 110.48 178.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.711 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 9.0 t -72.74 -26.4 61.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.583 172.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -80.3 -44.0 20.32 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.54 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.63 ' HD2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.48 -28.07 65.76 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.834 179.064 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.711 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -61.32 -50.15 74.11 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 171.132 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 124' ' ' LYS . 0.4 OUTLIER -59.18 -47.91 83.56 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 173.005 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -55.75 -35.7 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 118.18 0.446 . . . . 0.0 111.266 178.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.5 m170 -70.9 -32.0 68.82 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.82 0.343 . . . . 0.0 111.01 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 121' ' ' GLU . 68.3 tttt -66.21 -28.29 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.262 176.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 CA--C 1.536 0.415 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.164 175.783 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.825 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.6 Cg_exo . . . . . 0 N--CA 1.477 0.542 0 N-CA-C 114.377 0.876 . . . . 0.0 114.377 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.8 mp0 -45.68 -69.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.485 0.491 . . . . 0.0 111.341 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.6 tp -87.26 -9.48 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.709 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . 0.825 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 17.4 tmm? -65.48 -36.17 83.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.923 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.42 ' NZ ' ' HB3' ' A' ' 6' ' ' LYS . 8.8 mtpm? -86.51 97.45 10.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.025 0.44 . . . . 0.0 110.212 177.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -67.36 140.68 57.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.141 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mp -58.82 -38.98 79.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.052 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -58.51 -35.84 72.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.969 0.414 . . . . 0.0 110.805 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -75.39 -33.73 61.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.526 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -68.87 -56.59 7.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.318 176.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -52.19 -77.3 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 176.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.55 36.93 59.52 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.564 -170.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -84.97 -40.45 16.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.048 0.452 . . . . 0.0 110.666 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.48 59.43 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.688 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.1 tpt -70.11 -39.71 75.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.196 0.522 . . . . 0.0 110.263 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -61.2 -30.14 70.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.809 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -88.78 -20.52 24.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.01 -0.676 . . . . 0.0 111.919 -174.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -75.21 -32.55 61.22 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 168.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.972 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 26.2 tptp -61.32 -47.92 83.74 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.443 175.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -72.77 -38.16 67.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.802 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -61.12 -41.71 97.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.895 0.378 . . . . 0.0 110.79 -176.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.485 ' HB3' HD11 ' A' ' 47' ' ' LEU . 12.9 mt -86.6 -10.89 52.95 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.722 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t 57.55 41.68 25.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.55 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.972 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 16.2 mt -51.28 119.82 13.34 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.878 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.7 Cg_exo -72.24 157.94 52.77 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.751 2.301 . . . . 0.0 110.815 171.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.559 ' HA ' HG22 ' A' ' 30' ' ' VAL . 7.7 p-10 -65.17 -27.22 68.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -175.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.1 m -68.82 -39.64 79.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.902 0.382 . . . . 0.0 110.516 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.868 HG21 HD23 ' A' ' 47' ' ' LEU . 58.0 t -72.33 -44.52 63.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 27' ' ' ASP . 11.1 m -59.87 -31.7 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 110.566 175.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.65 -52.12 58.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.948 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -67.34 -36.37 81.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.32 -56.93 13.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.365 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -69.04 10.56 0.28 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -66.27 103.81 1.07 Allowed 'General case' 0 C--N 1.344 0.344 0 CA-C-N 120.108 1.322 . . . . 0.0 110.178 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -71.0 -32.37 69.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.109 -175.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -90.23 101.9 14.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.586 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HB2' ' NZ ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -72.64 79.69 1.09 Allowed 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.599 0.714 . . . . 0.0 110.443 179.248 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.81 12.89 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.49 -1.232 . . . . 0.0 114.056 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.0 t70 60.02 70.89 0.6 Allowed 'General case' 0 C--N 1.343 0.321 0 CA-C-N 118.695 0.68 . . . . 0.0 110.176 -168.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -115.52 176.35 5.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.762 177.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.7 t -108.89 121.62 62.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.1 ttm -77.68 100.65 6.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.4 p -94.21 -29.92 14.85 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.165 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -78.0 115.06 17.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.677 0.751 . . . . 0.0 110.13 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.915 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -57.27 -35.2 69.48 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.921 174.527 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.868 HD23 HG21 ' A' ' 29' ' ' VAL . 56.5 tp -64.92 -17.81 64.67 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 120.978 0.418 . . . . 0.0 110.795 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.67 1.8 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.03 -45.66 2.24 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 115.215 -0.902 . . . . 0.0 114.672 166.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 86.7 m -64.33 -42.64 96.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.307 1.053 . . . . 0.0 110.408 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.85 -25.11 67.76 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.646 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.1 mt -73.35 -35.57 46.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.188 0.518 . . . . 0.0 110.164 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -104.75 44.74 1.0 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.431 -175.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t -112.27 -47.95 3.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.94 -52.06 58.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.34 0.59 . . . . 0.0 111.037 -170.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -80.92 -11.58 59.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.273 -173.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.636 ' HA ' HG11 ' A' ' 61' ' ' VAL . 22.5 m -83.36 -35.25 25.28 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.525 175.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -78.1 -17.35 57.04 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.405 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mt -64.91 -66.96 0.48 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.57 172.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -178.29 121.75 0.1 Allowed 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.636 HG11 ' HA ' ' A' ' 57' ' ' THR . 11.9 p -176.63 34.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.906 0.86 . . . . 0.0 111.082 -175.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.536 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 33.6 m -108.52 115.5 49.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 O-C-N 121.158 -0.964 . . . . 0.0 111.422 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.22 -55.84 2.11 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.009 178.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 15.9 Cg_endo -97.47 -140.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.984 2.456 . . . . 0.0 113.165 -171.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.485 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 16.4 m-20 -72.89 6.71 2.41 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.48 -174.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.17 -75.35 0.43 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.739 HD22 HD23 ' A' ' 68' ' ' LEU . 3.0 p-10 -69.52 153.76 43.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.939 -0.63 . . . . 0.0 111.039 176.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.739 HD23 HD22 ' A' ' 67' ' ' ASN . 4.2 mm? 69.82 32.87 3.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.587 173.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.5 p-80 -73.73 76.28 1.56 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.388 0.613 . . . . 0.0 110.71 171.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -86.39 -59.12 2.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.699 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.7 -52.36 53.52 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.216 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -58.13 -34.4 70.21 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.832 -0.184 . . . . 0.0 111.458 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.601 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -67.83 -36.45 80.37 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.3 0.572 . . . . 0.0 111.184 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.5 mmmt -80.03 -37.66 33.61 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.61 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.28 -40.6 96.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.27 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 51.7 t80 -61.49 -40.56 95.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.45 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.28 73.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.96 0.41 . . . . 0.0 111.179 -178.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 53.0 mtt -74.34 -23.7 59.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.088 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -85.88 -15.49 41.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.732 -176.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -146.89 96.71 2.79 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.076 -176.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.54 -71.47 0.22 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.379 -0.915 . . . . 0.0 112.658 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.736 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.06 139.99 31.33 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.487 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.496 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.3 OUTLIER -84.04 166.18 17.94 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.361 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.46 -25.61 63.26 Favored 'General case' 0 N--CA 1.416 -2.168 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.414 -167.564 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.787 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.6 OUTLIER -73.87 -31.11 63.0 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.121 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 9.3 tpp -78.54 -48.0 16.14 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.82 0.819 . . . . 0.0 108.946 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.582 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -58.73 -36.7 74.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.409 176.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.704 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.14 -25.66 61.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.91 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 85' ' ' THR . 14.2 mm-40 -77.77 -25.3 49.0 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.5 tt -87.89 -43.62 11.66 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.862 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 88' ' ' GLN . 4.8 m -60.9 -27.89 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -66.47 -41.14 89.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.462 0.649 . . . . 0.0 109.861 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.531 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -66.46 -39.34 83.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 176.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 90' ' ' LEU . 49.3 mt -57.99 -47.39 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.146 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -69.71 -34.88 74.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.55 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.22 -53.09 3.77 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.058 -1.068 . . . . 0.0 112.515 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.7 m -72.42 -32.18 66.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.539 ' OE2' ' HE2' ' A' ' 110' ' ' LYS . 40.3 tt0 -67.21 -34.72 78.08 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.122 0.874 . . . . 0.0 110.114 173.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -63.67 -41.2 98.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.923 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.1 m -103.06 19.57 19.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.72 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.41 155.7 83.72 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.902 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 71.9 Cg_exo -48.41 135.84 26.01 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.692 2.261 . . . . 0.0 111.636 174.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.2 Cg_exo -70.51 49.32 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 123.686 2.924 . . . . 0.0 113.498 -176.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -125.35 94.37 4.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 173.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -81.13 84.96 6.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.087 -171.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.662 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.7 t70 -106.94 133.47 51.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.587 176.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -30.05 -75.28 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.712 1.258 . . . . 0.0 113.711 -175.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.915 ' HB2' ' HB2' ' A' ' 46' ' ' ARG . 98.1 m -88.63 -10.29 49.13 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.662 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -69.61 -41.17 76.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 -173.557 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HE2' ' OE2' ' A' ' 98' ' ' GLU . 14.3 ptmt -65.19 -51.0 63.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.778 0.799 . . . . 0.0 110.373 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.538 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -59.56 -14.27 12.49 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.575 174.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.59 -36.31 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 177.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -63.42 -35.26 79.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.356 176.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 16.0 m -76.36 -37.08 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.985 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.21 78.5 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.308 0.575 . . . . 0.0 111.367 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.624 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.2 ptt? -69.09 -17.68 63.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.281 178.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 31.8 t -73.54 -30.03 62.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.835 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -77.64 -43.23 32.12 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.585 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.578 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -70.42 -23.42 62.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.903 176.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.624 ' HE3' ' O ' ' A' ' 116' ' ' MET . 1.1 ttmt -62.23 -48.29 80.63 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 121.353 -0.842 . . . . 0.0 110.095 170.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -59.14 -45.0 92.09 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 119' ' ' LYS . 11.8 tt -58.92 -33.41 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-N 118.799 0.727 . . . . 0.0 110.675 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.462 ' HD2' HG23 ' A' ' 122' ' ' ILE . 9.8 m170 -71.1 -31.43 67.79 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.448 174.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -66.39 -35.28 79.93 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.527 0.331 . . . . 0.0 111.552 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 122' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.251 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo . . . . . 0 N--CA 1.462 -0.366 0 CA-C-O 120.683 0.201 . . . . 0.0 112.402 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -45.17 -68.11 0.23 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.173 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.0 tt -83.14 -9.62 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-O 121.002 0.429 . . . . 0.0 111.433 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.2 mmm -66.64 -26.02 66.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.203 0.525 . . . . 0.0 109.799 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -92.93 102.47 14.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.234 166.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -62.92 130.05 43.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 110.888 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 89.6 mt -65.18 -45.04 86.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.598 -176.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 m -60.5 -40.57 91.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.769 0.319 . . . . 0.0 110.771 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -75.89 -24.25 55.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.083 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.461 ' C ' HD22 ' A' ' 11' ' ' ASN . 0.2 OUTLIER -73.43 -50.79 19.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 175.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 34.9 m-85 -50.24 -77.99 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.353 173.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.44 38.52 62.89 Favored Glycine 0 C--N 1.343 0.954 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.717 -177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -68.12 -36.79 80.29 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 117.295 0.547 . . . . 0.0 110.512 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.29 101.52 3.13 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.629 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 50.9 ttm -70.15 -34.43 73.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.105 0.479 . . . . 0.0 109.805 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.35 -38.73 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.279 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -88.29 -25.99 22.51 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.644 -172.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t -75.53 -35.5 60.71 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -47.94 81.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.883 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.73 -37.31 41.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.832 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.52 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 33.9 tp10 -61.45 -41.47 97.26 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.348 0.118 . . . . 0.0 111.025 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 mm? -79.05 -22.48 45.3 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.325 172.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.2 m 58.44 50.54 9.23 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -170.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.642 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 25.4 mt -66.56 121.5 77.49 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.969 -171.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' CG2' ' A' ' 29' ' ' VAL . 11.8 Cg_exo -73.3 154.82 51.5 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.558 2.172 . . . . 0.0 110.841 171.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.638 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.0 p-10 -63.54 -23.6 67.46 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 m -65.79 -39.05 90.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.423 0.63 . . . . 0.0 109.85 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.557 ' CG2' ' HD2' ' A' ' 26' ' ' PRO . 58.9 t -70.57 -51.79 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.483 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.638 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.9 m -57.68 -30.51 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.167 0.508 . . . . 0.0 110.731 179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.86 -52.23 57.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.63 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.71 -35.68 65.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.804 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 19.3 tp -50.53 -55.46 15.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.793 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.418 ' HD1' ' O ' ' A' ' 30' ' ' VAL . 20.4 m-85 -77.41 11.45 1.97 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -175.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -58.85 111.39 1.27 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 118.28 0.491 . . . . 0.0 109.873 176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -79.05 -17.33 55.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.513 -171.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -91.03 124.71 35.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.633 0.254 . . . . 0.0 110.897 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -75.96 65.46 2.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.736 179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.718 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 36.5 t70 -54.89 -19.09 5.84 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.771 1.767 . . . . 0.0 115.771 178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.9 t70 62.63 70.61 0.55 Allowed 'General case' 0 C--N 1.348 0.517 0 CA-C-N 119.717 1.144 . . . . 0.0 109.59 -169.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.0 p90 -114.75 165.77 12.46 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.375 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.32 117.31 31.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.5 ttm -75.1 102.05 4.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.364 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -107.43 -16.69 14.31 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -77.98 130.94 37.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.479 . . . . 0.0 110.289 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.884 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 3.4 mpt_? -69.99 -27.07 64.41 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.297 -171.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.7 mm? -80.42 -15.73 56.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.053 -173.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.412 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.34 -61.12 2.03 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.0 -47.69 1.92 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.073 168.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 m -70.79 -42.5 70.26 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.448 1.124 . . . . 0.0 112.042 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.19 -6.28 38.33 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -177.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 48' ' ' ALA . 45.3 mm -57.02 -30.22 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.142 0.496 . . . . 0.0 110.151 172.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . 0.555 HD22 ' N ' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -145.49 86.14 1.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.162 -179.106 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' CYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.0 p -112.72 -47.93 3.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -177.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 52.7 tp -64.53 -55.41 20.74 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.076 0.465 . . . . 0.0 112.083 -170.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.29 -13.79 58.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.958 0.408 . . . . 0.0 110.268 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.617 HG23 HG11 ' A' ' 61' ' ' VAL . 30.5 m -74.54 -34.85 63.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.493 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.52 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 17.5 mmmt -81.17 -24.72 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.222 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 66.5 mt -64.74 -61.81 1.96 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.135 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -175.09 112.78 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.545 0.212 . . . . 0.0 110.802 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.617 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -170.3 32.24 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 121.969 0.89 . . . . 0.0 110.091 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.548 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 19.2 m -105.25 120.49 56.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 O-C-N 121.808 -0.557 . . . . 0.0 110.926 -175.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.404 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 1.9 t0 -75.39 -55.51 2.12 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.674 175.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' PRO . . . . . 0.665 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.5 Cg_endo -97.26 -143.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 123.112 2.541 . . . . 0.0 113.071 -172.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.511 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 7.6 t70 -72.22 -1.34 14.78 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.593 -175.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 144.14 -68.84 0.42 Allowed Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.164 -0.774 . . . . 0.0 111.164 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.665 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -75.35 149.76 38.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.885 -0.657 . . . . 0.0 111.202 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.622 HD23 HD22 ' A' ' 67' ' ' ASN . 4.5 mm? 69.28 37.66 2.03 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.017 172.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.585 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.3 p80 -72.6 80.63 1.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.304 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 28.6 p-80 -87.39 -59.82 2.14 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.8 -63.48 4.58 Favored Glycine 0 N--CA 1.462 0.368 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.296 -170.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -57.47 -24.62 56.85 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -177.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -74.37 -36.07 63.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.435 0.636 . . . . 0.0 111.144 178.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.634 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.1 mmmt -79.48 -33.63 42.06 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.71 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.578 172.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 87.7 t80 -57.28 -37.11 71.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.354 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.89 75.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.858 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 54.1 mtt -66.86 -36.24 81.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.901 -175.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -87.63 -14.92 38.73 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.111 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -136.65 89.57 2.47 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.021 -175.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.1 -62.04 0.3 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.077 -1.058 . . . . 0.0 112.361 171.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.95 132.16 35.98 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 121.134 0.492 . . . . 0.0 110.833 -177.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.76 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 91.5 m-20 -75.01 149.42 39.27 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.97 -33.52 64.87 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.884 -174.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.39 -26.4 60.08 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 122.344 -0.223 . . . . 0.0 110.94 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' MET . . . . . 0.76 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 17.9 mtm -86.38 -38.48 17.36 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -174.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . 0.509 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -63.73 -42.6 97.88 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.883 175.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.489 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -75.58 -25.61 57.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -176.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.97 -23.89 44.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.607 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' ILE . 60.0 tp -86.51 -48.17 8.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.244 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.489 HG22 ' HA ' ' A' ' 88' ' ' GLN . 16.8 m -57.69 -36.34 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.307 -174.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.02 -42.05 97.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.974 0.416 . . . . 0.0 110.091 -177.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.774 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mm -65.79 -42.34 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.896 175.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.502 HG13 ' O ' ' A' ' 90' ' ' LEU . 58.5 mt -55.43 -47.42 78.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.965 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -70.06 -34.29 73.03 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.439 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -44.07 7.06 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.301 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 0.782 ' HB2' HG12 ' A' ' 114' ' ' VAL . 68.6 m -72.56 -34.4 67.46 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.539 ' HG3' HG11 ' A' ' 114' ' ' VAL . 8.3 mt-10 -64.52 -37.54 87.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.436 0.562 . . . . 0.0 111.069 170.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -67.38 -41.88 84.32 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.821 0.343 . . . . 0.0 110.512 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.4 m -94.68 14.41 21.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.924 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -80.76 150.43 69.44 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.91 159.94 50.97 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 122.606 2.204 . . . . 0.0 110.567 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.12 84.77 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.337 2.024 . . . . 0.0 111.232 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -126.29 108.81 11.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.992 -176.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -83.37 26.69 0.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -169.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.465 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 2.8 p30 -89.73 105.29 17.71 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 122.467 1.127 . . . . 0.0 111.642 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.5 tttp -29.28 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 114.674 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -84.61 -9.97 57.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.659 0.266 . . . . 0.0 111.525 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.884 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 91.7 mmm -85.12 -21.37 29.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -172.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -57.69 -45.31 85.83 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 122.095 0.95 . . . . 0.0 109.975 177.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.568 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.38 -12.49 3.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.261 174.227 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.3 mp -89.52 -38.85 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 13.8 m-20 -60.67 -36.94 79.99 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.767 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' VAL . . . . . 0.782 HG12 ' HB2' ' A' ' 97' ' ' CYS . 10.9 m -76.77 -38.21 29.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.91 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.06 -49.08 77.39 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 121.448 0.642 . . . . 0.0 111.546 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' MET . . . . . 0.692 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.13 -23.46 63.97 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.766 179.034 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' CYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 9.3 t -69.43 -26.74 64.75 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 123.344 0.658 . . . . 0.0 109.529 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -75.3 -46.92 30.43 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.262 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.4 ' HA ' ' HB ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -68.53 -25.63 65.02 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 118.345 -1.342 . . . . 0.0 111.15 178.522 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' LYS . . . . . 0.692 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.37 -56.56 18.75 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 109.878 168.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . 0.483 ' HG3' HD11 ' A' ' 93' ' ' ILE . 20.4 mm-40 -59.94 -42.73 94.66 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.507 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.413 HG22 ' HD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -56.52 -34.19 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 118.126 0.421 . . . . 0.0 111.351 177.235 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' HIS . . . . . 0.413 ' HD2' HG22 ' A' ' 122' ' ' ILE . 12.2 m170 -72.19 -31.93 66.34 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.088 -0.383 . . . . 0.0 111.39 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -69.53 -30.54 68.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.269 0.556 . . . . 0.0 110.419 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 97.8 mt . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.202 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.8 p . . . . . 0 N--CA 1.481 1.109 0 CA-C-O 120.371 0.129 . . . . 0.0 110.951 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.651 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.9 Cg_endo -65.65 -21.28 59.26 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.817 2.345 . . . . 0.0 112.855 -177.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.01 -69.07 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.568 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.46 HD12 ' HA ' ' A' ' 4' ' ' ILE . 6.6 tp -80.61 -9.71 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 121.132 0.491 . . . . 0.0 111.638 -176.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.651 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 78.4 mtp -73.98 -21.18 60.09 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.47 176.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -74.1 91.68 2.11 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 171.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -73.04 131.84 42.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.52 -174.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 71.6 mt -55.99 -47.49 77.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.124 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.624 ' HB3' HD23 ' A' ' 55' ' ' LEU . 49.2 m -61.89 -29.97 70.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.438 -179.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -75.27 -36.04 61.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.987 0.422 . . . . 0.0 110.295 178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -68.71 -52.65 28.49 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.985 178.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -51.41 -78.01 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 173.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 55.5 35.49 61.74 Favored Glycine 0 C--N 1.343 0.958 0 C-N-CA 120.781 -0.723 . . . . 0.0 113.631 -175.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -75.65 -41.17 54.81 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.071 0.436 . . . . 0.0 111.42 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.91 99.36 3.39 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.861 0.362 . . . . 0.0 111.227 -173.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.33 -46.68 14.35 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.255 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.07 -30.74 71.32 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.948 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -87.82 -21.99 24.74 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.727 -175.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.2 t -75.21 -34.97 61.53 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 167.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.793 ' HA ' HD13 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -61.16 -45.58 94.06 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.897 178.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -71.16 -40.37 71.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.788 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.632 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 30.6 tp10 -60.09 -44.07 95.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 121.373 -0.131 . . . . 0.0 111.042 -173.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.726 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 20.4 mt -88.44 -8.58 54.7 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.496 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 54.5 m 57.68 37.57 27.36 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.133 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.793 HD13 ' HA ' ' A' ' 20' ' ' LYS . 5.0 mp -54.08 121.53 30.62 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.293 -178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.96 155.4 68.24 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.191 1.927 . . . . 0.0 110.878 172.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -60.68 -31.98 71.21 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -175.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.7 p -63.8 -40.4 96.55 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.707 0.289 . . . . 0.0 111.444 179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 30.5 t -76.21 -55.73 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.643 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.4 p -59.61 -28.79 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-O 120.935 0.398 . . . . 0.0 110.865 -176.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.56 -51.43 35.49 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.29 -35.98 82.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.318 0.58 . . . . 0.0 110.031 178.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -38.62 69.68 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.259 -0.882 . . . . 0.0 111.395 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -78.54 8.9 4.53 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 176.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.473 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 43.7 t30 -65.65 107.74 1.84 Allowed 'General case' 0 C--O 1.231 0.095 0 CA-C-N 118.709 0.686 . . . . 0.0 109.747 178.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.2 t80 -81.16 -18.38 46.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.227 -173.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.473 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 30.4 m-90 -73.45 131.71 42.12 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 177.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -80.71 53.29 1.87 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.268 -0.424 . . . . 0.0 112.125 -173.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.571 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 37.7 t70 -43.73 -42.67 5.55 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 172.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.4 t70 66.36 61.31 0.59 Allowed 'General case' 0 C--N 1.347 0.48 0 CA-C-O 121.716 0.769 . . . . 0.0 109.929 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.571 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -97.28 177.32 5.6 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.152 -0.931 . . . . 0.0 111.107 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 34.2 t -84.29 126.37 40.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.74 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 37.5 ttm -67.11 103.46 1.2 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 178.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.0 p -101.72 -26.74 13.39 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -173.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.605 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 15.3 t70 -101.62 122.51 44.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.69 0.757 . . . . 0.0 112.493 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 1.023 ' HB2' ' HB3' ' A' ' 108' ' ' CYS . 0.1 OUTLIER -47.59 -40.94 20.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 114.224 -1.353 . . . . 0.0 113.132 172.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.807 HD22 ' HG2' ' A' ' 46' ' ' ARG . 2.9 mm? -65.87 -19.24 65.81 Favored 'General case' 0 C--N 1.333 -0.144 0 O-C-N 122.021 -0.425 . . . . 0.0 111.068 -176.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -82.08 -61.24 1.96 Allowed 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.43 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -39.12 -48.13 2.65 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-N 114.688 -1.142 . . . . 0.0 114.504 168.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.5 m -67.31 -41.95 84.51 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.405 1.102 . . . . 0.0 111.674 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -63.24 -23.86 67.61 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.9 mt -58.09 -39.23 71.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 CA-C-O 120.992 0.425 . . . . 0.0 110.946 177.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.489 ' O ' ' HB ' ' A' ' 57' ' ' THR . 3.7 p-10 -113.84 42.84 1.93 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.481 0.658 . . . . 0.0 110.16 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 10.6 t -98.75 -46.4 5.69 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.656 -177.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 9' ' ' SER . 4.4 mm? -60.31 -55.88 28.24 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.024 0.44 . . . . 0.0 111.963 -174.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.09 -16.62 49.41 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 120.731 -0.387 . . . . 0.0 110.909 -172.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 53' ' ' ASN . 18.1 m -84.93 -42.37 15.04 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.372 177.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.632 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 5.8 mmmt -72.76 -15.97 61.65 Favored 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.373 177.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 tt -63.84 -65.92 0.61 Allowed 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 172.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -176.28 119.14 0.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.056 179.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.466 ' CG1' HG23 ' A' ' 57' ' ' THR . 9.2 p -175.62 31.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 121.54 0.686 . . . . 0.0 111.327 -177.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.545 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 32.9 m -93.34 118.72 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 O-C-N 121.147 -0.971 . . . . 0.0 111.401 -177.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.31 -53.27 10.67 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.505 175.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.681 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -98.99 -143.77 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.026 0 C-N-CA 123.345 2.696 . . . . 0.0 112.999 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 6.3 p-10 -72.21 -5.72 37.8 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.633 -170.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 151.41 -60.96 0.41 Allowed Glycine 0 C--N 1.316 -0.572 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.681 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.0 OUTLIER -85.36 165.48 17.21 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.815 -0.692 . . . . 0.0 109.817 176.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.09 29.79 4.62 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.308 0.575 . . . . 0.0 111.308 171.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.577 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 9.2 p80 -73.4 74.3 1.38 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.192 0.52 . . . . 0.0 111.794 177.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -86.38 -50.86 6.6 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.13 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.4 -61.71 6.58 Favored Glycine 0 N--CA 1.45 -0.424 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.948 -172.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -56.68 -31.08 64.08 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.67 -37.95 76.89 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.219 0.533 . . . . 0.0 110.968 -178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -79.73 -35.59 38.66 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.786 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -65.0 -40.96 95.72 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.457 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -63.57 -38.78 92.43 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.663 178.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.94 -37.09 78.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.066 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.521 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 72.0 mtm -73.63 -23.46 59.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.812 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -93.22 -14.26 27.31 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.935 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 -144.99 95.41 2.68 Favored 'General case' 0 CA--C 1.523 -0.061 0 CA-C-O 120.742 0.306 . . . . 0.0 111.042 -177.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.38 -70.11 0.42 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.236 173.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -103.72 135.4 45.34 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.4 ' OD1' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -80.21 172.56 13.61 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 175.197 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -23.25 67.16 Favored 'General case' 0 N--CA 1.422 -1.872 0 C-N-CA 120.273 -0.571 . . . . 0.0 110.604 -167.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 1.2 t -73.19 -30.9 63.86 Favored 'General case' 0 C--N 1.309 -1.178 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.481 -177.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.581 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 71.9 mtp -81.93 -41.2 21.19 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-O 121.376 0.608 . . . . 0.0 109.362 -175.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.583 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -62.29 -33.23 74.25 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.235 176.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.74 -21.45 51.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.25 -179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.816 ' HG2' ' O ' ' A' ' 85' ' ' THR . 10.6 mm-40 -77.74 -25.31 49.14 Favored 'General case' 0 N--CA 1.463 0.179 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 172.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.517 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.2 mp -85.45 -42.94 14.03 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.604 -178.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.583 HG13 ' O ' ' A' ' 87' ' ' ALA . 29.8 m -56.91 -32.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 CA-C-O 120.86 0.362 . . . . 0.0 111.809 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.17 -44.91 78.52 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.601 -178.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.636 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.5 mp -67.62 -43.75 86.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 90' ' ' LEU . 50.0 mt -52.67 -48.7 48.16 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.223 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.786 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -71.7 -36.54 70.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.196 -174.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.33 -44.4 6.6 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 119.722 -1.228 . . . . 0.0 112.367 -172.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.739 ' HB2' HG12 ' A' ' 114' ' ' VAL . 38.7 m -72.23 -41.11 67.2 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.854 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.501 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.4 tt0 -63.89 -38.79 92.4 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 117.948 0.34 . . . . 0.0 110.798 176.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -67.14 -34.46 77.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.821 0.343 . . . . 0.0 111.074 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.1 m -95.79 5.34 51.57 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.259 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.33 149.44 78.91 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.719 -178.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.474 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 22.7 Cg_exo -65.37 144.53 80.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.731 2.287 . . . . 0.0 111.195 178.009 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 7.9 Cg_exo -73.37 35.52 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.315 0 C-N-CA 123.425 2.75 . . . . 0.0 113.314 -175.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -76.77 112.08 12.97 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -77.75 96.22 4.85 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -167.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.74 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.0 t0 -144.04 100.73 3.61 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 163.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 44.0 pttt -40.77 -44.75 2.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.051 1.5 . . . . 0.0 115.051 -179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' A' ' 46' ' ' ARG . 4.1 t -88.06 -24.58 23.41 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.583 1.083 . . . . 0.0 112.232 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.74 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 75.4 mmm -74.76 -26.39 59.73 Favored 'General case' 0 C--O 1.235 0.309 0 O-C-N 121.987 -0.445 . . . . 0.0 111.884 -175.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.556 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -60.14 -43.03 96.04 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.766 0.793 . . . . 0.0 110.032 178.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.556 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.03 -14.9 7.46 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.459 -1.246 . . . . 0.0 112.35 174.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.565 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.5 mp -89.95 -38.0 10.45 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 14.4 t70 -60.06 -34.11 72.97 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.432 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.739 HG12 ' HB2' ' A' ' 97' ' ' CYS . 14.0 m -80.57 -39.47 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.144 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.574 177.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.75 -49.64 76.68 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 121.323 0.582 . . . . 0.0 111.29 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.718 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.84 -24.67 63.49 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.305 178.918 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.4 t -71.17 -23.33 62.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.171 0.51 . . . . 0.0 110.137 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.568 ' HA ' HG12 ' A' ' 93' ' ' ILE . 73.7 t80 -79.65 -45.87 18.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.123 179.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 pttp -69.27 -28.8 66.63 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.021 -0.672 . . . . 0.0 109.71 177.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.718 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.54 -51.06 71.48 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.916 0.389 . . . . 0.0 110.452 170.349 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -57.52 -54.9 41.64 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.67 177.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -58.14 -32.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-O 120.699 0.285 . . . . 0.0 111.44 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -71.22 -30.63 66.59 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.625 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.0 OUTLIER -72.28 -33.07 67.17 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt -66.36 -40.05 89.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.56 172.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 64.3 t30 49.47 -85.03 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.531 1.133 . . . . 0.0 113.71 172.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -77.79 100.17 6.19 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.557 0.694 . . . . 0.0 111.656 -174.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.3 p -135.5 103.47 10.3 Favored Pre-proline 0 C--N 1.322 -0.597 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.184 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -75.15 138.02 22.14 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 123.022 2.481 . . . . 0.0 112.302 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -90.41 151.64 21.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.053 179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.94 -7.6 58.57 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.365 -177.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 67.73 117.58 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 O-C-N 123.883 0.739 . . . . 0.0 111.593 -175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 6.3 mp -86.45 65.56 9.1 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.948 -177.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 11.9 m -76.23 107.79 7.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.566 0.698 . . . . 0.0 110.949 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.9 120.06 63.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.778 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -96.56 96.69 1.93 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.578 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -75.37 95.26 3.19 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.6 m -82.36 96.73 3.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.52 0.676 . . . . 0.0 111.505 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -95.22 103.13 14.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -100.61 107.2 18.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.43 . . . . 0.0 110.885 -177.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -77.09 147.64 36.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.47 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.424 ' O ' HG13 ' A' ' 142' ' ' VAL . 11.4 p . . . . . 0 C--O 1.248 0.989 0 O-C-N 124.473 1.108 . . . . 0.0 112.498 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.3 m . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.679 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 18.5 Cg_endo -57.99 -21.91 52.38 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.361 2.707 . . . . 0.0 114.384 -173.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -49.5 -69.13 0.12 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.72 0.295 . . . . 0.0 111.501 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.88 HD11 ' HB2' ' A' ' 82' ' ' ALA . 5.2 mm -80.16 -15.08 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-O 121.092 0.472 . . . . 0.0 111.676 178.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.679 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 13.4 tmm? -64.64 -38.2 90.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.016 0.436 . . . . 0.0 110.267 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -93.45 120.38 33.67 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.36 178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 -71.79 133.83 45.78 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.789 -179.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.604 HD11 ' O ' ' A' ' 80' ' ' HIS . 50.7 mt -57.7 -43.15 84.97 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.035 0.209 . . . . 0.0 110.914 178.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.0 m -61.79 -38.72 89.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.897 0.379 . . . . 0.0 110.763 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -75.47 -34.56 60.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.4 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -67.19 -54.05 24.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.678 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HD2' ' O ' ' A' ' 8' ' ' LEU . 32.9 m-85 -47.45 -73.02 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.459 168.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.01 40.23 58.18 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.306 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.459 ' C ' ' HD3' ' A' ' 14' ' ' LYS . 12.2 tmtt? -67.48 -58.14 5.27 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.1 90.46 1.36 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.684 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 64.6 mtt -71.62 -27.19 62.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.251 0.548 . . . . 0.0 109.773 177.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 37.3 t70 -62.27 -24.69 67.42 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.799 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -88.13 -25.14 23.14 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.197 -175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.6 t -76.13 -36.58 58.74 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.636 ' HA ' HD22 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.76 -42.09 97.88 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 177.462 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -71.3 -42.85 68.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.088 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -70.24 -41.46 73.5 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.352 -174.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.827 ' HB2' HD13 ' A' ' 25' ' ' LEU . 15.3 mt -83.48 1.17 43.1 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.972 0.415 . . . . 0.0 111.291 -177.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.8 m 67.38 31.92 6.14 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.721 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.827 HD13 ' HB2' ' A' ' 23' ' ' LEU . 8.4 mp -62.15 121.4 65.78 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.724 175.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 12.5 Cg_exo -71.07 160.22 49.91 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.89 2.393 . . . . 0.0 111.167 173.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.767 ' HA ' HG22 ' A' ' 30' ' ' VAL . 4.6 p-10 -69.4 -16.42 63.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.725 0.298 . . . . 0.0 111.34 -176.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 p -64.85 -48.83 72.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 0.0 110.341 174.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.2 t -71.0 -45.82 70.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.256 -177.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.767 HG22 ' HA ' ' A' ' 27' ' ' ASP . 14.9 m -59.28 -30.04 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 120.975 0.417 . . . . 0.0 110.043 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.54 -52.19 54.34 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.798 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -67.02 -36.11 81.38 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 121.104 0.478 . . . . 0.0 110.202 177.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.68 -54.99 25.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.177 173.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -66.95 11.08 0.11 Allowed 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 115.985 1.846 . . . . 0.0 115.985 178.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -64.36 118.27 8.46 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 120.02 1.282 . . . . 0.0 110.063 178.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -92.55 -36.33 13.09 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.4 p90 -77.39 151.18 34.94 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.217 -178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -80.13 60.24 3.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.951 -168.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -55.49 -36.33 66.52 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.713 171.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.1 t0 59.41 70.92 0.61 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.51 0.671 . . . . 0.0 110.087 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.414 ' O ' ' HD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -102.22 164.66 11.57 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.68 -179.283 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 51.2 t -85.44 115.16 26.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 173.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.617 ' O ' HG21 ' A' ' 112' ' ' ILE . 39.4 ttp -72.49 99.08 2.41 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.028 -177.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.8 p -110.48 -9.99 14.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.839 -175.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -80.41 134.22 35.98 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-O 121.851 0.834 . . . . 0.0 110.443 178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.723 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 6.2 mpt_? -72.99 -29.12 62.81 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.227 -1.352 . . . . 0.0 110.681 -170.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB3' ' HG ' ' A' ' 25' ' ' LEU . 3.3 mm? -76.13 -15.25 60.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.495 -178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.582 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -84.46 -58.73 2.62 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.8 -47.53 1.8 Allowed Glycine 0 CA--C 1.531 1.091 0 CA-C-N 115.187 -0.915 . . . . 0.0 114.096 167.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.423 ' HB3' HD13 ' A' ' 23' ' ' LEU . 7.3 m -66.55 -43.93 83.72 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 118.292 1.046 . . . . 0.0 111.641 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.705 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -67.82 -23.97 65.24 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.87 0.367 . . . . 0.0 111.861 -177.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 48' ' ' ALA . 37.2 mm -65.6 -32.41 58.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.981 0.42 . . . . 0.0 110.835 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -132.12 53.7 1.98 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.499 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.576 ' SG ' HD12 ' A' ' 55' ' ' LEU . 25.8 p -115.16 -44.05 3.04 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.59 178.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' SG ' ' A' ' 54' ' ' CYS . 9.0 mp -54.52 -44.0 72.4 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.197 0.523 . . . . 0.0 111.534 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.407 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -79.8 -11.74 59.81 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.318 -173.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.806 ' HA ' ' CG1' ' A' ' 61' ' ' VAL . 13.2 m -83.63 -33.17 25.35 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.646 0.736 . . . . 0.0 110.211 174.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 13.3 mmmt -71.26 -31.48 67.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.249 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -65.95 -67.07 0.47 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.72 172.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -178.97 123.21 0.09 Allowed 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.546 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.806 ' CG1' ' HA ' ' A' ' 57' ' ' THR . 7.9 p -177.42 32.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 CA-C-O 121.431 0.634 . . . . 0.0 112.171 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.537 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.1 m -101.34 123.22 54.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.691 -1.256 . . . . 0.0 111.42 -177.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.462 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 12.3 t70 -73.5 -54.29 4.09 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.891 174.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.74 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 57.0 Cg_endo -104.62 -139.4 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 123.398 2.732 . . . . 0.0 113.066 -171.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.52 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 18.3 m-20 -73.25 3.0 6.27 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.673 -175.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.41 -75.47 0.33 Allowed Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.785 -0.722 . . . . 0.0 111.35 -178.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.697 HD22 HD23 ' A' ' 68' ' ' LEU . 1.2 p-10 -76.53 157.05 32.4 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.183 -0.508 . . . . 0.0 110.742 177.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.697 HD23 HD22 ' A' ' 67' ' ' ASN . 4.3 mm? 69.49 34.17 2.89 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.585 0.553 . . . . 0.0 111.22 176.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.74 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.7 p80 -73.71 79.98 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.439 176.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -87.69 -57.25 3.01 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.424 -179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.12 -63.08 5.03 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 121.18 -0.533 . . . . 0.0 113.086 -169.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 61.6 t30 -59.36 -22.86 61.96 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.435 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -72.7 -33.83 66.74 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.042 0.449 . . . . 0.0 110.965 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 74' ' ' LYS . 29.8 mmmt -78.82 -31.62 45.93 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.059 177.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -64.96 -39.97 94.29 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 172.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.407 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 88.7 t80 -61.64 -36.89 82.08 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.704 177.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.17 -40.85 74.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.828 0.346 . . . . 0.0 110.991 179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.563 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 73.9 mtm -75.18 -19.76 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.199 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.2 tptt -90.13 -16.26 29.95 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.231 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.604 ' O ' HD11 ' A' ' 8' ' ' LEU . 52.9 m-70 -143.27 96.34 2.9 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.653 0.263 . . . . 0.0 110.37 -175.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.85 -62.64 0.3 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.125 172.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.88 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.43 139.74 38.93 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.046 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.474 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.7 OUTLIER -82.25 169.02 17.03 Favored 'General case' 0 CA--C 1.493 -1.227 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 168.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 12.2 pt-20 -68.09 -22.65 64.9 Favored 'General case' 0 N--CA 1.409 -2.487 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.298 -165.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.474 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.4 t -73.22 -29.43 62.79 Favored 'General case' 0 C--N 1.308 -1.23 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.08 -175.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 61.1 mtm -87.22 -38.82 16.01 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -178.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.61 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.21 -37.64 80.93 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.321 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -77.2 -21.85 53.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.275 -179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -77.23 -22.12 52.74 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.027 171.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 94' ' ' ILE . 28.8 tp -88.26 -39.38 14.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.65 -179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.2 m -57.59 -35.92 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -171.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.71 -38.13 83.18 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.036 -175.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.895 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.5 mp -65.79 -39.59 85.24 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 171.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.6 mt -58.04 -48.19 84.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.259 -0.428 . . . . 0.0 109.988 -178.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.1 m170 -70.93 -36.4 72.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.517 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.12 -46.09 6.02 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.17 -170.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 93' ' ' ILE . 48.7 m -72.73 -38.27 67.49 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 116.494 0.147 . . . . 0.0 110.919 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -57.55 -39.3 76.35 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 122.295 -0.253 . . . . 0.0 110.983 170.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -74.33 -43.01 58.48 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.144 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.1 m -94.57 14.55 20.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.708 -173.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -62.21 151.39 81.71 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.472 ' C ' ' H ' ' A' ' 104' ' ' ASN . 51.5 Cg_exo -56.63 163.26 7.23 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 122.924 2.416 . . . . 0.0 112.189 179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -66.92 33.34 0.13 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.482 2.788 . . . . 0.0 113.168 177.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.472 ' H ' ' C ' ' A' ' 102' ' ' PRO . 2.4 m-20 -121.81 101.9 7.86 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -79.56 96.12 6.05 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.99 0.9 . . . . 0.0 109.546 178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -90.42 104.73 17.27 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.619 -175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -31.29 -77.26 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.715 0 O-C-N 124.824 1.328 . . . . 0.0 113.735 -169.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 42.2 t -95.91 -11.08 27.21 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.826 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 1.9 tmm? -86.89 -16.34 36.3 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 121.636 0.731 . . . . 0.0 112.613 -169.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.562 ' HG3' ' H ' ' A' ' 111' ' ' THR . 22.5 pttt -55.59 -45.94 77.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.769 0.795 . . . . 0.0 111.068 -173.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.626 HG23 HD12 ' A' ' 112' ' ' ILE . 12.6 t -57.33 -13.73 3.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.426 -1.261 . . . . 0.0 112.843 177.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.672 ' O ' ' HG2' ' A' ' 116' ' ' MET . 1.7 mp -90.45 -37.35 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -58.09 -37.03 73.73 Favored 'General case' 0 C--N 1.339 0.145 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.687 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -79.42 -36.48 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 CA-C-O 121.38 0.609 . . . . 0.0 110.447 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.17 -51.19 70.64 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.373 176.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.698 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 19.5 ptt? -69.59 -17.89 63.58 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.201 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.528 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 53.0 t -73.26 -22.36 60.41 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 173.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.895 ' HB2' HG21 ' A' ' 93' ' ' ILE . 54.2 t80 -81.0 -46.3 15.27 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.686 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.29 -17.52 63.09 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 118.309 -1.356 . . . . 0.0 109.397 175.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.698 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.47 -55.3 21.67 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.149 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 8.0 mm-40 -58.95 -51.3 70.65 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.642 175.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -54.33 -32.9 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 178.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 34.4 m170 -70.9 -32.8 69.86 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 122.038 -0.413 . . . . 0.0 112.057 177.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 51.1 tptt -73.76 -34.37 64.68 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.441 0.638 . . . . 0.0 109.959 174.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 79.1 mt -76.16 4.74 8.0 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.011 -0.995 . . . . 0.0 111.936 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -92.38 126.76 37.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.007 0.432 . . . . 0.0 110.537 -176.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . 0.575 ' O ' ' HD3' ' A' ' 129' ' ' PRO . 11.4 p-90 -109.3 179.65 4.09 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.744 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.99 103.3 16.67 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 121.315 0.579 . . . . 0.0 110.925 -179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.575 ' HD3' ' O ' ' A' ' 127' ' ' TRP . 5.4 Cg_exo -80.21 127.21 6.63 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.874 2.382 . . . . 0.0 111.632 178.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -93.81 3.53 55.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.87 0.843 . . . . 0.0 109.276 178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 23.5 ptp -128.87 158.21 39.38 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.66 178.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -146.24 97.22 2.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.885 0.85 . . . . 0.0 110.107 171.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -94.29 83.23 4.18 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.536 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 6.4 m -86.16 88.84 2.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.318 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -101.18 124.86 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.794 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.797 -178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 155.38 32.95 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 110.634 -0.987 . . . . 0.0 110.634 -176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -77.02 109.41 10.83 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.179 -0.51 . . . . 0.0 110.576 -176.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 61.0 t -87.02 124.04 40.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 176.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 50.4 tp -75.57 103.6 5.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.425 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -114.5 81.89 1.63 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.637 -178.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.767 ' HG3' HG23 ' A' ' 142' ' ' VAL . 16.8 pt-20 -99.26 -35.61 9.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.438 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.767 HG23 ' HG3' ' A' ' 141' ' ' GLU . 19.7 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.591 -0.719 . . . . 0.0 109.285 178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 120.52 0.2 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.401 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.4 Cg_endo -65.91 -21.91 56.59 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.52 2.147 . . . . 0.0 112.351 -179.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.29 -66.47 0.39 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.044 177.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.7 tp -75.36 -15.6 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 CA-C-O 121.17 0.51 . . . . 0.0 111.517 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.401 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 73.7 mtp -76.84 -40.61 47.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.862 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -80.12 97.05 6.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.91 -179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -62.38 123.27 17.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.342 -176.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 mp -60.07 -36.41 77.29 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.286 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 m -60.29 -34.64 74.06 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 110.767 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -75.0 -32.76 61.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.019 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 68.7 m-20 -67.92 -45.06 75.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.721 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -57.1 -86.5 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 169.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.81 37.91 44.41 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.492 -178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -61.45 -59.31 5.44 Favored 'General case' 0 C--N 1.335 -0.042 0 CA-C-O 121.227 0.536 . . . . 0.0 110.437 177.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.45 100.55 3.55 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.965 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.508 ' HG2' ' OH ' ' A' ' 34' ' ' TYR . 17.0 tpt -74.61 -22.3 59.02 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.759 -178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -53.89 -31.53 50.21 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.473 -175.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 26.3 mt-30 -87.42 -21.33 25.66 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.834 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 23' ' ' LEU . 32.1 t -75.27 -36.17 61.26 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 170.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.77 ' HA ' HD23 ' A' ' 25' ' ' LEU . 29.7 tptp -58.27 -51.07 71.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.636 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -72.13 -47.79 48.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.91 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.519 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 5.8 mm-40 -69.7 -32.28 70.79 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 54' ' ' CYS . 1.5 mm? -90.6 -21.46 21.71 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 61.91 50.28 4.28 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.117 -176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -63.12 125.7 87.48 Favored Pre-proline 0 CA--C 1.52 -0.188 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.959 177.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.7 Cg_exo -64.68 150.6 87.92 Favored 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 121.696 1.597 . . . . 0.0 109.4 168.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -54.99 -33.82 62.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.909 0.385 . . . . 0.0 111.676 -173.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -78.58 -29.84 46.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.004 -174.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.434 HG11 ' CB ' ' A' ' 47' ' ' LEU . 26.1 t -77.22 -49.44 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.497 0 C-N-CA 121.101 -0.24 . . . . 0.0 111.303 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 8.5 p -60.43 -27.36 39.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-O 121.114 0.483 . . . . 0.0 109.811 177.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.91 -52.02 33.77 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.699 173.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -63.65 -33.29 75.29 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 110.321 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.1 tp -51.02 -55.46 17.36 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.722 170.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.508 ' OH ' ' HG2' ' A' ' 16' ' ' MET . 18.4 m-85 -68.51 12.15 0.14 Allowed 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 176.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.56 123.33 16.52 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 119.859 1.208 . . . . 0.0 110.419 -173.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -72.26 -36.24 68.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.719 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.2 m-90 -92.9 101.82 14.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.245 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.3 mtmm -76.37 78.17 3.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.186 0.517 . . . . 0.0 109.896 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.549 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 34.5 t70 -62.51 12.1 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 114.94 1.459 . . . . 0.0 114.94 -177.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 48.0 t0 53.81 43.05 31.53 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 119.227 0.921 . . . . 0.0 110.047 -174.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.549 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 13.1 p90 -86.7 175.02 8.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.981 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -95.59 125.63 48.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 176.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.463 ' HE1' HD11 ' A' ' 52' ' ' ILE . 42.6 ttm -68.45 103.65 1.71 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.058 0.456 . . . . 0.0 110.251 178.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.9 p -93.31 -39.47 10.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.842 -174.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -83.57 134.56 34.81 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.924 0.868 . . . . 0.0 111.025 -176.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.516 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 4.2 mpt_? -74.98 -30.14 61.09 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.11 -1.404 . . . . 0.0 110.149 -173.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.625 HD12 HD13 ' A' ' 25' ' ' LEU . 3.7 mm? -66.55 -15.23 63.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.796 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.505 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.74 -56.76 3.93 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.582 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.33 -47.29 3.61 Favored Glycine 0 CA--C 1.535 1.339 0 CA-C-N 114.933 -1.03 . . . . 0.0 114.58 165.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 20.8 m -66.28 -44.52 83.33 Favored 'General case' 0 C--N 1.343 0.29 0 CA-C-N 118.786 1.293 . . . . 0.0 110.28 -178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.18 -17.3 63.79 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.553 -175.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 48' ' ' ALA . 71.4 mt -54.37 -37.76 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 121.083 0.468 . . . . 0.0 110.22 175.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -143.79 71.96 1.34 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.317 0.58 . . . . 0.0 109.725 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.481 ' HB2' HD21 ' A' ' 23' ' ' LEU . 23.1 p -104.52 -45.93 4.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.385 176.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 58.4 tp -62.37 -47.28 84.86 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.417 -176.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.84 -16.25 51.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.904 0.383 . . . . 0.0 110.772 -173.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.48 HG23 ' CG1' ' A' ' 61' ' ' VAL . 55.3 m -84.06 -36.93 22.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.587 174.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 15.6 mmmt -68.31 -25.0 64.9 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.246 -0.284 . . . . 0.0 111.273 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.3 mt -64.49 -66.09 0.59 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 121.098 -0.241 . . . . 0.0 110.934 176.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -176.76 121.83 0.14 Allowed 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.515 0.198 . . . . 0.0 110.744 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.48 ' CG1' HG23 ' A' ' 57' ' ' THR . 13.9 p -173.29 50.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 122.256 1.027 . . . . 0.0 110.267 -176.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.59 ' HA ' ' HB2' ' A' ' 69' ' ' HIS . 1.5 m -110.1 125.8 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 O-C-N 121.601 -0.687 . . . . 0.0 111.249 -173.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -76.78 -56.14 1.4 Allowed Pre-proline 0 CA--C 1.533 0.324 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.265 178.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 16.4 Cg_endo -98.34 -139.52 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 123.504 2.803 . . . . 0.0 112.851 -171.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.502 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 28.8 t70 -71.5 -1.5 13.55 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.512 -177.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.44 -65.57 0.5 Allowed Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.34 -175.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.9 p-10 -76.31 149.57 37.04 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.912 -0.644 . . . . 0.0 111.549 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 68.6 40.67 1.83 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.318 0.58 . . . . 0.0 111.176 174.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 62' ' ' VAL . 8.3 p80 -74.73 69.54 1.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.511 179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -82.22 -50.71 8.69 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.91 -56.16 26.34 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.837 -173.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.68 -27.75 66.68 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.939 0.348 . . . . 0.0 111.939 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.38 -36.71 66.12 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 121.454 0.645 . . . . 0.0 110.722 -178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 48.2 mttp -78.65 -37.85 41.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.68 -179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.496 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 18.9 t70 -66.72 -32.49 73.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.464 173.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -57.69 -42.04 82.88 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-O 120.995 0.426 . . . . 0.0 110.126 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.96 -34.86 73.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.679 176.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 72.7 mtm -74.42 -26.49 60.11 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 4.8 ptpp? -93.03 -18.47 22.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 119.714 -0.795 . . . . 0.0 110.933 177.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.407 ' NE2' ' HD3' ' A' ' 79' ' ' LYS . 14.8 m170 -134.53 91.44 2.78 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 124.31 -74.52 0.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.258 -0.972 . . . . 0.0 112.705 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -91.74 132.61 36.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.867 0.365 . . . . 0.0 111.315 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.484 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -85.11 173.57 10.36 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 172.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -59.59 -34.45 72.75 Favored 'General case' 0 N--CA 1.418 -2.058 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -170.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.795 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 5.2 t -63.61 -31.42 72.59 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.362 -177.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 46.1 mtt -82.5 -39.66 22.14 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 -177.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.437 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -64.23 -37.32 87.07 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-N 114.893 -1.049 . . . . 0.0 109.556 177.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.453 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -75.69 -26.17 57.36 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.734 -0.667 . . . . 0.0 111.502 -175.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.795 ' HG2' ' O ' ' A' ' 85' ' ' THR . 54.2 mm-40 -80.14 -24.26 40.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.67 172.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.469 ' O ' HG13 ' A' ' 94' ' ' ILE . 42.0 tp -84.15 -46.38 11.97 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.085 -176.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.453 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.2 m -56.88 -36.76 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.869 -176.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -67.58 -43.53 80.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.437 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.731 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.6 mp -69.11 -43.32 81.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.245 177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 90' ' ' LEU . 59.7 mt -55.65 -47.79 78.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.669 -179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 52.3 m170 -71.06 -35.16 71.82 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.698 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.15 -45.25 6.32 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.491 -173.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' A' ' 93' ' ' ILE . 60.1 m -72.65 -37.05 68.09 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 119.353 -0.356 . . . . 0.0 111.117 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -64.09 -39.32 93.81 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.282 0.492 . . . . 0.0 110.719 172.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.6 tptm -66.92 -34.15 77.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 121.08 0.467 . . . . 0.0 110.48 179.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 m -104.09 17.19 24.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.973 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.76 155.97 67.95 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.252 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.06 143.84 91.68 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 121.968 1.779 . . . . 0.0 110.473 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.55 72.28 0.43 Allowed 'Trans proline' 0 C--O 1.236 0.401 0 C-N-CA 122.665 2.243 . . . . 0.0 112.908 -176.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -125.62 95.21 4.36 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.823 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -76.51 96.31 4.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.191 0.519 . . . . 0.0 111.321 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 1.074 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.2 t70 -143.92 120.34 10.98 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.756 174.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.566 ' HB2' ' NZ ' ' A' ' 107' ' ' LYS . 3.9 ttmp? -34.68 -60.84 0.42 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 114.126 1.158 . . . . 0.0 114.126 178.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.418 ' O ' HD13 ' A' ' 112' ' ' ILE . 5.9 m -89.51 -10.13 47.42 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 1.074 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 1.3 tmm? -69.03 -42.97 75.65 Favored 'General case' 0 C--O 1.243 0.728 0 CA-C-O 122.214 1.007 . . . . 0.0 110.092 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.591 ' HG3' ' H ' ' A' ' 111' ' ' THR . 14.4 ptpt -64.92 -49.98 68.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.169 -1.378 . . . . 0.0 111.342 -172.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.591 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 11.6 t -57.98 -14.98 7.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.68 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.582 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.5 mp -91.66 -40.71 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 8.5 t70 -61.94 -34.91 76.96 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.078 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.662 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.1 m -81.53 -37.38 15.36 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.216 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.865 178.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.2 -51.78 68.1 Favored 'General case' 0 C--O 1.244 0.78 0 CA-C-O 120.817 0.341 . . . . 0.0 111.795 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.651 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.43 -26.02 64.4 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 119.737 -0.785 . . . . 0.0 110.015 179.635 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 32.3 t -68.52 -24.76 64.69 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 121.112 0.482 . . . . 0.0 109.837 176.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.61 ' HA ' HG12 ' A' ' 93' ' ' ILE . 37.8 t80 -77.31 -49.73 14.37 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.845 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.54 -23.65 61.81 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.824 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -59.92 -54.43 46.27 Favored 'General case' 0 C--N 1.346 0.421 0 CA-C-N 118.869 0.758 . . . . 0.0 109.367 167.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.442 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 6.8 tp10 -58.07 -50.4 73.6 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.87 178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.85 -32.89 22.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 117.742 0.246 . . . . 0.0 111.161 177.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.423 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 2.7 m-70 -71.29 -32.88 69.17 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 175.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -78.47 -31.26 47.79 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.476 0.655 . . . . 0.0 109.862 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 91.4 mt -72.47 11.36 0.63 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.52 175.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 123' ' ' HIS . 19.4 t-20 -55.87 152.61 9.68 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 8.9 p-90 -73.69 78.02 1.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 122.155 0.978 . . . . 0.0 110.403 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.515 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 30.6 m -120.5 137.63 26.45 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.495 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 2.8 Cg_exo -77.03 114.19 3.76 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 123.06 2.507 . . . . 0.0 111.999 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.607 ' HB3' ' OD1' ' A' ' 132' ' ' ASP . 55.8 t30 -95.23 176.76 6.09 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 22.2 ptp -79.51 7.86 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.651 0.262 . . . . 0.0 111.21 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.607 ' OD1' ' HB3' ' A' ' 130' ' ' ASN . 4.4 p-10 -94.15 127.98 40.29 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 50.0 tp -116.93 122.58 44.7 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.152 178.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 13.4 m -119.28 111.17 32.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.154 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 38.9 mm -109.7 100.61 11.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.243 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -80.94 94.52 1.57 Allowed Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.184 176.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -76.11 148.04 38.15 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.884 0.373 . . . . 0.0 110.686 -177.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 62.2 t -123.14 125.33 71.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.689 -178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 55.4 tp -126.58 112.08 15.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.877 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -122.23 -166.57 1.43 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.239 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -111.64 148.94 32.28 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.026 0.441 . . . . 0.0 110.35 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.408 -0.806 . . . . 0.0 109.858 178.541 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.487 0.184 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.2 Cg_exo -59.04 -22.1 62.15 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.959 2.439 . . . . 0.0 112.552 178.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -50.03 -67.91 0.22 Allowed 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.313 0.383 . . . . 0.0 111.341 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.896 HD11 ' HB2' ' A' ' 82' ' ' ALA . 23.4 mm -76.17 -16.25 15.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 121.066 0.46 . . . . 0.0 111.326 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.446 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 5.2 tmm? -68.4 -43.62 76.84 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.517 ' HE3' ' OD1' ' A' ' 11' ' ' ASN . 41.9 tptt -80.73 85.54 6.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.356 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.465 ' OD1' ' HB2' ' A' ' 10' ' ' ASN . 3.0 p30 -62.65 125.55 24.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.218 -175.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.704 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.9 pt? -61.85 -30.2 70.69 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.506 -177.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.5 m -61.6 -41.49 97.53 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.796 0.331 . . . . 0.0 110.855 -179.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.465 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m120 -78.05 -18.9 55.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.13 176.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.603 ' ND2' ' HA ' ' A' ' 8' ' ' LEU . 96.9 m-20 -66.51 -52.18 48.73 Favored 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -57.21 -84.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.941 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.54 34.79 35.7 Favored Glycine 0 C--N 1.344 0.989 0 C-N-CA 121.356 -0.45 . . . . 0.0 114.111 178.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.97 -56.27 23.75 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 117.272 0.536 . . . . 0.0 111.163 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.638 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -144.64 107.31 4.43 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.886 0.374 . . . . 0.0 110.879 -177.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.7 mtm -70.18 -32.5 70.47 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.747 0.308 . . . . 0.0 110.818 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.7 -22.8 67.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.915 -177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.638 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 3.2 pt20 -83.94 -27.02 28.81 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.077 -176.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.8 t -75.47 -35.64 60.83 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 173.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.32 -48.28 80.51 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.043 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.75 -44.13 43.21 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.276 -176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -63.3 -41.82 99.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.452 0.168 . . . . 0.0 111.262 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' HD22 ' A' ' 25' ' ' LEU . 3.4 mm? -79.21 -22.82 44.34 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.8 m 60.83 50.02 5.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.801 -1.09 . . . . 0.0 110.301 -175.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.6 mm? -61.29 131.08 92.14 Favored Pre-proline 0 N--CA 1.461 0.122 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.057 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 5.8 Cg_exo -73.69 154.24 49.17 Favored 'Trans proline' 0 N--CA 1.461 -0.411 0 C-N-CA 122.144 1.896 . . . . 0.0 110.441 168.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.587 ' HA ' HG22 ' A' ' 30' ' ' VAL . 0.9 OUTLIER -65.98 -26.98 67.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.018 0.437 . . . . 0.0 110.801 -176.077 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.8 m -63.37 -40.67 97.88 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.279 0.561 . . . . 0.0 110.073 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.519 HG11 ' HB2' ' A' ' 47' ' ' LEU . 24.4 t -77.22 -43.8 31.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.342 -176.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.587 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.7 m -56.02 -37.24 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-O 121.157 0.503 . . . . 0.0 109.997 178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.19 -51.91 58.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.672 178.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.63 -37.1 86.41 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.163 0.506 . . . . 0.0 110.524 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.97 -43.48 95.06 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.419 -0.809 . . . . 0.0 112.02 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -77.0 9.68 2.81 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.6 p-10 -65.93 131.56 46.55 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.048 0.84 . . . . 0.0 110.666 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -91.1 -7.72 50.89 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.994 0.425 . . . . 0.0 110.903 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 6.9 m-90 -91.15 102.38 15.12 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.687 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt -90.52 65.46 6.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -62.77 12.58 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 16.2 t0 54.54 71.52 0.52 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 119.559 1.072 . . . . 0.0 109.75 -169.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -115.34 157.12 24.29 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.245 -176.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 67.1 t -86.2 116.15 28.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.454 ' SD ' ' HB3' ' A' ' 48' ' ' ALA . 55.3 tpp -71.26 103.71 2.91 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.566 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.5 p -99.94 -9.13 23.13 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -90.39 127.78 36.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 109.718 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.606 ' N ' ' HD3' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -78.48 -19.59 52.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.288 -170.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 25' ' ' LEU . 3.7 mm? -75.76 -19.37 59.07 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.228 179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' HB3' ' SD ' ' A' ' 43' ' ' MET . . . -85.29 -59.07 2.43 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -176.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.42 -47.68 2.86 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-N 115.176 -0.92 . . . . 0.0 114.083 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 6.0 m -65.4 -45.49 83.78 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 118.207 1.003 . . . . 0.0 111.619 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -73.14 -3.06 24.15 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.0 mm -59.73 -35.78 61.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 172.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -145.2 82.65 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 173.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 21.4 p -108.79 -45.53 3.8 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.889 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.488 HD11 ' H ' ' A' ' 15' ' ' ALA . 6.7 tt -63.99 -44.43 92.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.932 -174.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.63 55.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.037 0.446 . . . . 0.0 110.371 -174.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.47 HG23 HG11 ' A' ' 61' ' ' VAL . 43.6 m -80.9 -32.0 34.96 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.581 175.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 19.2 mmmt -82.04 -16.75 49.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.846 177.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 11.2 mt -66.71 -67.17 0.47 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 171.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -178.1 127.71 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.47 HG11 HG23 ' A' ' 57' ' ' THR . 9.3 p -172.56 32.95 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 122.109 0.957 . . . . 0.0 109.778 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.0 m -102.79 120.95 53.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 O-C-N 121.769 -0.582 . . . . 0.0 111.605 -174.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -71.3 -56.78 5.06 Favored Pre-proline 0 CA--C 1.535 0.375 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.427 174.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 17.8 Cg_endo -100.74 -140.86 0.01 OUTLIER 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.355 2.703 . . . . 0.0 113.271 -170.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.514 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 24.1 m-20 -75.3 5.49 5.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.58 -175.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 139.75 -75.46 0.36 Allowed Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 -177.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.757 HD22 HD23 ' A' ' 68' ' ' LEU . 2.0 p-10 -69.07 156.77 38.1 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.827 -0.686 . . . . 0.0 110.901 178.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.757 HD23 HD22 ' A' ' 67' ' ' ASN . 4.0 mm? 70.05 29.21 3.91 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.266 0.626 . . . . 0.0 112.533 174.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.594 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.6 p-80 -78.08 67.57 3.95 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.254 0.549 . . . . 0.0 111.284 174.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.452 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 9.0 p80 -86.61 -45.74 10.75 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.837 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.96 -55.36 30.77 Favored Glycine 0 N--CA 1.45 -0.404 0 CA-C-N 115.849 -0.614 . . . . 0.0 112.317 -176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.8 t-20 -59.94 -28.39 67.58 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 115.705 -0.248 . . . . 0.0 111.488 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.62 -34.98 74.83 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.345 0.593 . . . . 0.0 110.983 179.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 70.5 mmtt -78.56 -37.32 43.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.499 0.666 . . . . 0.0 109.241 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.77 -40.01 94.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.637 175.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -62.59 -34.06 76.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.073 177.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.08 -32.08 69.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.994 177.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 89.1 mtp -70.67 -35.14 72.69 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.778 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -90.28 -14.83 32.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.478 178.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.456 ' O ' HD13 ' A' ' 8' ' ' LEU . 70.3 m-70 -140.05 92.88 2.58 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.361 179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.29 -73.59 0.46 Allowed Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.876 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.896 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -104.39 145.26 30.52 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.959 0.409 . . . . 0.0 111.248 -175.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -87.78 177.13 7.09 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.027 175.205 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.55 -40.45 65.56 Favored 'General case' 0 N--CA 1.434 -1.26 0 CA-C-N 114.96 -1.018 . . . . 0.0 112.38 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.727 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 13.0 t -72.12 -33.55 67.9 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.553 -0.459 . . . . 0.0 111.119 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.483 ' HB2' ' HB1' ' A' ' 82' ' ' ALA . 68.6 mtp -81.4 -39.15 25.43 Favored 'General case' 0 CA--C 1.508 -0.67 0 O-C-N 121.96 -0.463 . . . . 0.0 109.886 -173.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -60.22 -37.92 81.78 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 173.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.438 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.36 -24.93 60.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.685 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.727 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.2 mm-40 -79.87 -25.92 40.5 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 120.404 -0.518 . . . . 0.0 109.898 173.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 22.7 tp -87.62 -44.2 11.4 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.954 -174.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 87' ' ' ALA . 14.5 m -57.24 -36.03 50.65 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.179 -176.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.41 -44.18 95.35 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.952 0.406 . . . . 0.0 110.181 -179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.449 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -68.32 -42.38 84.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.234 175.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 57.8 mt -54.87 -49.2 72.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.307 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.1 m170 -70.77 -35.12 72.45 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.487 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.4 -56.39 2.84 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.26 -172.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 21.7 m -72.73 -29.73 63.59 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -176.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.17 -34.17 76.97 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.631 0.651 . . . . 0.0 110.108 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 50.8 tptt -70.39 -42.96 71.02 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.832 0.349 . . . . 0.0 111.137 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.5 p -94.08 10.37 33.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.763 0.316 . . . . 0.0 111.688 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB1' ' HD2' ' A' ' 102' ' ' PRO . . . -64.53 156.3 77.93 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 175.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.445 ' HD2' ' HB1' ' A' ' 101' ' ' ALA . 9.8 Cg_endo -50.87 156.4 4.74 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.251 2.634 . . . . 0.0 112.464 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.7 Cg_exo -68.68 24.48 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 123.555 2.837 . . . . 0.0 113.496 -175.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.435 ' H ' ' C ' ' A' ' 102' ' ' PRO . 17.0 m120 -110.79 105.12 13.86 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 174.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -75.54 84.95 2.61 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.159 0.504 . . . . 0.0 109.944 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.736 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.8 t70 -101.17 103.94 15.0 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.563 178.108 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -37.58 -50.39 1.14 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.283 -1.326 . . . . 0.0 114.317 179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.556 ' O ' HG22 ' A' ' 111' ' ' THR . 5.4 t -95.26 -20.93 18.78 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 119.037 0.835 . . . . 0.0 113.189 -176.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.736 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 56.2 mmm -74.55 -29.07 61.22 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 119.026 0.83 . . . . 0.0 112.334 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 111' ' ' THR . 27.5 pttt -56.34 -45.45 80.39 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.492 -172.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 108' ' ' CYS . 14.6 t -57.61 -16.36 10.13 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.711 178.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.538 ' O ' ' HG3' ' A' ' 116' ' ' MET . 3.1 mp -90.07 -37.2 9.33 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 177.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -59.43 -37.98 79.5 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.865 176.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 10.4 m -78.95 -37.45 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 C-N-CA 120.288 -0.565 . . . . 0.0 110.55 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.01 -52.67 64.01 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.982 -178.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.538 ' HG3' ' O ' ' A' ' 112' ' ' ILE . 0.0 OUTLIER -69.72 -19.73 63.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.396 178.681 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.588 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 5.0 t -71.58 -30.62 66.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.493 173.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.417 ' HA ' HG12 ' A' ' 93' ' ' ILE . 86.7 t80 -76.78 -45.95 26.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.794 -178.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' HG22 ' A' ' 122' ' ' ILE . 3.3 pttp -70.32 -30.0 66.87 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.357 -178.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.588 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -66.69 -44.44 81.75 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.179 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.591 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 23.9 mm-40 -59.01 -53.54 57.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.172 174.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.524 ' HA ' HD12 ' A' ' 125' ' ' LEU . 8.5 tt -55.74 -32.93 32.74 Favored 'Isoleucine or valine' 0 C--N 1.345 0.4 0 CA-C-N 118.023 0.374 . . . . 0.0 111.401 -178.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 7.2 m170 -71.3 -33.37 69.64 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 177.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.2 ttpt -76.59 -15.58 59.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.238 0.542 . . . . 0.0 110.7 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 87.0 mt -81.18 10.49 5.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.601 177.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -135.0 -126.62 0.16 Allowed 'General case' 0 CA--C 1.532 0.25 0 O-C-N 122.236 -0.29 . . . . 0.0 110.281 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 33.3 m95 -67.11 99.71 0.7 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.967 0.413 . . . . 0.0 111.598 -178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 12.9 p -164.35 132.67 2.67 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.203 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 3.9 Cg_exo -78.15 54.99 5.16 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.091 2.527 . . . . 0.0 111.599 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -79.42 106.41 11.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.019 0.438 . . . . 0.0 110.644 -178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.7 ptt? -147.55 123.0 10.37 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.932 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -117.72 162.76 17.53 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.22 -176.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.4 tp -77.47 99.45 5.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.89 0.376 . . . . 0.0 110.043 176.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 11.0 m -66.23 111.67 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.859 178.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -88.12 133.73 29.88 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 CA-C-O 121.083 0.468 . . . . 0.0 110.251 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -132.5 136.18 8.58 Favored Glycine 0 N--CA 1.443 -0.867 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.39 110.85 12.49 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.666 0.27 . . . . 0.0 110.857 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 32.3 t -89.09 76.96 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.536 ' CD1' ' H ' ' A' ' 139' ' ' LEU . 0.0 OUTLIER -78.3 138.61 38.68 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.759 -174.556 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -124.42 101.07 6.97 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.576 -178.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -77.09 146.44 37.24 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.1 m . . . . . 0 C--O 1.248 1.015 0 CA-C-O 119.071 -0.49 . . . . 0.0 111.399 -177.869 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.706 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 8.0 m . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 111.463 0.172 . . . . 0.0 111.463 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.706 ' HD3' ' HB2' ' A' ' 1' ' ' SER . 36.2 Cg_exo -62.83 -18.05 62.61 Favored 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 122.517 2.145 . . . . 0.0 113.578 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 mp0 -45.02 -69.52 0.13 Allowed 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.544 0.527 . . . . 0.0 112.133 -176.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.606 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -87.2 -9.09 11.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -177.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.415 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 75.4 mtp -74.93 -25.6 59.01 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.93 0.395 . . . . 0.0 111.162 -177.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 2' ' ' PRO . 21.3 pttp -97.03 89.26 4.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.449 0.642 . . . . 0.0 109.721 173.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -65.02 125.18 24.09 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.003 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -59.32 -33.85 71.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.781 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -61.86 -38.07 86.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.164 0.507 . . . . 0.0 110.082 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.8 t30 -75.39 -30.91 60.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.302 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -68.24 -55.99 10.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.296 177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.0 m-85 -47.78 -74.95 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.034 173.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.621 ' HA2' ' HG3' ' A' ' 16' ' ' MET . . . 54.65 33.48 55.03 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 120.916 -0.659 . . . . 0.0 114.219 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -68.38 -43.05 78.21 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 117.506 0.653 . . . . 0.0 110.189 178.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.12 66.78 1.31 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.172 0.51 . . . . 0.0 110.905 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.621 ' HG3' ' HA2' ' A' ' 13' ' ' GLY . 73.4 mtm -70.35 -25.01 63.08 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.78 -31.86 62.98 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 114.455 -1.248 . . . . 0.0 111.663 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 23.9 mt-30 -87.97 -25.37 23.2 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.059 -0.656 . . . . 0.0 111.091 -172.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -71.46 -35.33 70.84 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 170.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.937 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -62.31 -52.62 62.93 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.114 -178.063 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.03 -36.95 67.04 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.53 -175.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.415 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 15.6 tt0 -68.63 -42.27 78.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.727 0.299 . . . . 0.0 111.201 -175.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.749 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 18.0 mt -84.2 -1.08 54.52 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.822 0.344 . . . . 0.0 110.664 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.1 t 63.69 36.59 10.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.304 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.937 ' HB2' ' HD3' ' A' ' 20' ' ' LYS . 1.2 mm? -49.41 119.16 8.87 Favored Pre-proline 0 N--CA 1.471 0.59 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.73 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.564 ' HD2' ' CD2' ' A' ' 47' ' ' LEU . 12.7 Cg_exo -73.93 154.17 47.87 Favored 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.416 2.077 . . . . 0.0 109.861 167.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -55.79 -32.9 63.91 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.443 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.4 m -66.03 -53.02 43.74 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.855 -175.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.579 ' CB ' HD23 ' A' ' 47' ' ' LEU . 36.0 t -70.35 -50.68 44.4 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.718 -176.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.518 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 8.8 p -59.7 -33.4 51.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.47 -0.492 . . . . 0.0 111.152 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.93 -51.17 58.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.556 177.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.92 -32.58 73.14 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.064 -178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.6 tp -48.44 -55.38 11.05 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.081 171.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -64.92 13.39 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 115.149 1.537 . . . . 0.0 115.149 177.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.466 ' OD1' ' HE3' ' A' ' 37' ' ' TRP . 52.0 t30 -53.86 122.31 9.76 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 119.521 1.055 . . . . 0.0 111.803 -172.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -71.79 -33.15 68.33 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.917 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.466 ' HE3' ' OD1' ' A' ' 35' ' ' ASN . 31.0 m-90 -79.04 145.41 33.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.14 0.495 . . . . 0.0 110.965 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.57 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -90.65 54.28 2.65 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.462 -173.516 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.508 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 27.7 t70 -43.52 -42.59 5.03 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 13.9 t70 63.08 70.44 0.54 Allowed 'General case' 0 C--N 1.348 0.521 0 CA-C-N 118.861 0.755 . . . . 0.0 109.853 -175.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.508 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 1.5 p90 -106.3 175.5 5.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.8 -175.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 93.6 t -84.1 125.14 40.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.754 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttp -77.71 96.03 4.77 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.214 0.531 . . . . 0.0 110.226 178.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.4 p -103.42 -39.11 6.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.755 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.408 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 10.2 t70 -69.42 124.85 24.96 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.74 0.781 . . . . 0.0 110.07 -179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.561 ' HG2' ' HG2' ' A' ' 109' ' ' MET . 2.5 mpt_? -79.89 -28.06 39.92 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.496 -1.229 . . . . 0.0 108.717 -168.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.737 HD11 HD22 ' A' ' 25' ' ' LEU . 7.4 tp -69.61 -19.06 63.65 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.948 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.57 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -78.37 -60.61 2.3 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 107.762 -1.199 . . . . 0.0 107.762 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.91 -46.78 1.78 Allowed Glycine 0 CA--C 1.534 1.227 0 CA-C-N 114.399 -1.273 . . . . 0.0 114.654 167.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 74.2 m -66.85 -43.61 83.2 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 118.522 1.161 . . . . 0.0 110.619 -177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.5 -22.07 66.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.761 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 48' ' ' ALA . 47.8 mm -61.83 -36.23 72.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-O 120.903 0.382 . . . . 0.0 111.127 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -122.2 76.88 1.34 Allowed 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.557 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 15.7 p -125.19 -47.29 1.76 Allowed 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.301 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.9 tt -63.53 -65.51 0.67 Allowed 'General case' 0 C--O 1.237 0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 111.786 -168.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.15 -12.47 59.21 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.252 0.548 . . . . 0.0 110.016 -174.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.538 ' HA ' HG11 ' A' ' 61' ' ' VAL . 56.3 m -83.9 -33.05 24.83 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.726 176.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 58' ' ' LYS . 8.1 mmmt -75.35 -23.44 57.2 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.363 175.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.5 mt -63.79 -66.28 0.56 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.571 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -177.4 123.96 0.13 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.588 HG23 ' CD2' ' A' ' 76' ' ' PHE . 10.4 p -178.67 34.57 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.99 0.9 . . . . 0.0 110.139 -174.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.716 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 28.1 m -98.82 114.02 35.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.802 0.811 . . . . 0.0 112.227 -170.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.23 -56.31 10.99 Favored Pre-proline 0 CA--C 1.536 0.419 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.954 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.565 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 13.6 Cg_endo -97.91 -138.98 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.913 0 C-N-CA 123.311 2.674 . . . . 0.0 113.254 -170.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.494 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.2 m-20 -72.24 2.39 6.06 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.538 -0.756 . . . . 0.0 112.622 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.19 -75.92 0.3 Allowed Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 110.653 -0.979 . . . . 0.0 110.653 -178.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.8 p-10 -75.17 170.91 15.11 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.803 -0.699 . . . . 0.0 110.317 173.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 69.66 29.79 4.11 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.519 0.512 . . . . 0.0 111.621 173.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.716 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 3.5 p80 -73.11 79.89 1.24 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.392 0.615 . . . . 0.0 110.984 177.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.435 ' H ' ' CD2' ' A' ' 70' ' ' HIS . 5.6 p80 -85.1 -58.85 2.52 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.651 -177.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -63.0 -61.49 6.37 Favored Glycine 0 N--CA 1.443 -0.867 0 C-N-CA 121.154 -0.545 . . . . 0.0 113.171 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -54.1 -36.02 62.76 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -176.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -71.55 -37.89 71.07 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 121.204 0.525 . . . . 0.0 111.337 -175.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.461 ' NZ ' HG21 ' A' ' 94' ' ' ILE . 92.2 mttt -81.37 -30.45 33.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.002 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.13 -41.64 94.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.144 173.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.588 ' CD2' HG23 ' A' ' 61' ' ' VAL . 2.5 m-85 -62.57 -36.65 83.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.857 176.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.9 -40.27 75.73 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.639 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.629 ' HB3' ' CB ' ' A' ' 87' ' ' ALA . 1.7 ptt? -76.92 -14.87 59.82 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.645 ' HG3' ' HD2' ' A' ' 80' ' ' HIS . 18.5 ptpt -90.88 -18.61 24.5 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.126 173.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.645 ' HD2' ' HG3' ' A' ' 79' ' ' LYS . 12.3 p80 -149.77 99.49 2.86 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 120.683 0.278 . . . . 0.0 111.565 172.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 132.18 -75.97 0.41 Allowed Glycine 0 C--O 1.234 0.123 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.099 178.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.606 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -89.22 149.94 22.88 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 172.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.651 ' OD2' ' HB ' ' A' ' 85' ' ' THR . 0.8 OUTLIER -88.7 167.4 13.36 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.579 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -72.56 -23.31 60.96 Favored 'General case' 0 N--CA 1.421 -1.907 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.716 -166.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.651 ' HB ' ' OD2' ' A' ' 83' ' ' ASP . 0.9 OUTLIER -73.29 -34.35 65.71 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.338 176.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.474 ' HA ' HE21 ' A' ' 89' ' ' GLN . 3.3 tpt -77.27 -43.52 33.02 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.111 -177.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.629 ' CB ' ' HB3' ' A' ' 78' ' ' MET . . . -65.24 -41.59 94.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.353 175.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 84' ' ' GLU . 2.9 mp0 -69.23 -26.25 64.7 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -175.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.474 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.7 pt20 -82.78 -28.9 29.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.844 175.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.505 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -76.93 -46.73 23.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.497 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 87' ' ' ALA . 25.4 m -57.69 -35.9 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.892 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.21 -44.51 88.06 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-O 120.924 0.392 . . . . 0.0 110.567 -176.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.582 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.2 mp -60.21 -42.66 91.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.455 174.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.506 ' HA ' ' HB ' ' A' ' 114' ' ' VAL . 59.6 mt -55.25 -47.17 78.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.312 179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -67.07 -31.45 71.95 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.429 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 99' ' ' LYS . . . -80.97 -50.67 5.08 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.373 -0.918 . . . . 0.0 112.374 -173.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 13.8 m -73.61 -32.75 64.24 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.171 -0.612 . . . . 0.0 112.21 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 94' ' ' ILE . 8.7 tp10 -57.89 -38.48 75.87 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 118.434 0.561 . . . . 0.0 110.416 168.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 96' ' ' GLY . 31.8 ttpt -63.48 -40.85 98.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.592 177.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.8 m -102.11 24.41 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.305 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -88.69 152.92 49.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 55.7 Cg_endo -69.87 162.19 43.08 Favored 'Trans proline' 0 CA--C 1.529 0.249 0 C-N-CA 122.578 2.186 . . . . 0.0 112.275 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 17.0 Cg_exo -69.2 59.01 1.33 Allowed 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.402 2.735 . . . . 0.0 112.587 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -103.93 113.28 26.7 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.504 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -79.0 16.31 0.94 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.811 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.1 t70 -90.85 112.18 23.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.093 0.473 . . . . 0.0 110.581 -176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.63 ' HE3' ' HA ' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -41.47 -54.25 3.17 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 179.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.557 ' O ' HD13 ' A' ' 112' ' ' ILE . 68.4 m -83.33 -21.91 33.04 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 119.371 0.987 . . . . 0.0 112.187 -176.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.811 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 5.7 mmm -63.33 -44.54 94.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.161 0.505 . . . . 0.0 110.57 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.634 ' HA ' ' OD2' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -66.17 -49.26 67.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.058 -177.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.448 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -57.64 -13.83 4.53 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.98 175.183 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.2 mp -91.06 -41.56 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 O-C-N 121.933 -0.479 . . . . 0.0 110.03 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.634 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 3.2 p30 -63.08 -34.15 76.97 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.494 177.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 18.8 m -80.09 -36.31 16.62 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.49 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.53 -50.5 72.42 Favored 'General case' 0 C--O 1.252 1.227 0 CA-C-O 121.701 0.763 . . . . 0.0 111.339 176.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.756 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.3 ptt? -68.72 -17.75 64.12 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.784 178.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 25.8 t -71.92 -30.55 65.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.601 176.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.582 ' HB2' HG21 ' A' ' 93' ' ' ILE . 85.4 t80 -72.04 -44.91 62.6 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.776 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.429 ' HE2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.68 -29.25 66.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 118.139 -1.424 . . . . 0.0 111.276 179.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.756 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.61 -56.21 19.15 Favored 'General case' 0 C--N 1.345 0.39 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.756 170.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.53 -51.04 71.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.409 178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -57.23 -32.79 41.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 118.22 0.464 . . . . 0.0 111.287 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 18.3 m170 -71.98 -31.9 66.72 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.455 174.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 53.8 tttp -79.05 -36.19 41.4 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 -176.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.779 ' HA ' ' HB ' ' A' ' 128' ' ' VAL . 0.5 OUTLIER -72.15 -15.31 61.97 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 178.116 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -56.88 -54.63 44.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.748 0.309 . . . . 0.0 111.398 173.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 26.0 p-90 -112.22 27.12 9.93 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 -179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.779 ' HB ' ' HA ' ' A' ' 125' ' ' LEU . 7.0 p -40.01 109.12 0.56 Allowed Pre-proline 0 N--CA 1.468 0.472 0 O-C-N 124.125 0.891 . . . . 0.0 113.007 -171.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -94.12 -19.63 0.41 Allowed 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 123.293 2.662 . . . . 0.0 113.318 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 45.6 t-20 -90.33 94.61 9.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.119 0.485 . . . . 0.0 110.51 -176.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 88.8 mmm -121.09 21.45 11.26 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 172.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -111.4 119.89 40.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.652 -173.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 53.5 tp -160.09 111.4 1.95 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.325 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.5 p -86.99 102.44 12.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.568 0.699 . . . . 0.0 110.654 178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.589 HD13 ' H ' ' A' ' 135' ' ' ILE . 0.2 OUTLIER -98.42 118.95 45.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.935 178.049 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 174.35 143.27 4.33 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.963 -1.113 . . . . 0.0 112.41 176.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.585 ' HG2' ' H ' ' A' ' 138' ' ' VAL . 25.3 tt0 -128.24 176.88 7.33 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 176.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.585 ' H ' ' HG2' ' A' ' 137' ' ' GLU . 34.4 m -85.05 116.5 28.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.19 0.519 . . . . 0.0 111.458 -176.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 7.2 mp -74.23 92.86 2.27 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -88.45 169.69 11.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.769 -169.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -100.85 152.79 20.1 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.684 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.874 0 CA-C-O 119.584 -0.246 . . . . 0.0 110.396 -179.919 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.475 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 65.4 p . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.624 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 2.6 Cg_exo -77.27 5.73 4.86 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 123.546 2.83 . . . . 0.0 114.921 -170.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -49.06 -70.57 0.09 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -177.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.607 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.9 tp -86.31 -9.47 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 121.124 0.488 . . . . 0.0 111.467 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.624 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 85.3 mtp -77.71 -30.6 51.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.959 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.638 ' HE2' HD21 ' A' ' 11' ' ' ASN . 82.2 tttt -84.7 94.37 8.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.219 0.533 . . . . 0.0 109.838 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 62.1 t30 -71.94 115.6 11.35 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.182 -174.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 8' ' ' LEU . 5.8 mp -58.48 -37.73 76.14 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.075 -0.511 . . . . 0.0 112.342 -174.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.548 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 6.1 p -65.08 -28.74 69.67 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.96 179.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -75.98 -26.51 56.83 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.894 175.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.638 HD21 ' HE2' ' A' ' 6' ' ' LYS . 5.1 m-20 -66.82 -45.66 77.59 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 174.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.548 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 67.9 m-85 -55.23 -84.37 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.381 171.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.02 36.79 15.33 Favored Glycine 0 C--N 1.345 1.068 0 C-N-CA 121.227 -0.511 . . . . 0.0 113.688 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -66.34 -37.62 85.75 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.812 0.339 . . . . 0.0 111.012 -177.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.14 92.23 2.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.071 0.462 . . . . 0.0 109.85 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttp -71.32 -33.08 69.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.0 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -58.0 -29.3 65.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.064 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -88.52 -21.23 24.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.876 -172.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.9 t -74.85 -36.17 62.36 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 172.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -63.49 -45.56 90.17 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.384 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -70.84 -47.63 58.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.87 -178.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.9 tp10 -67.96 -40.69 83.15 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -175.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.45 ' HB2' HD22 ' A' ' 25' ' ' LEU . 2.2 mm? -77.81 -21.52 51.43 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 176.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 61.67 48.16 5.83 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.843 -178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.875 HD23 ' HA ' ' A' ' 20' ' ' LYS . 1.7 mm? -61.29 128.34 89.52 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.359 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.643 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.4 Cg_exo -66.46 149.85 84.42 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.812 1.675 . . . . 0.0 109.694 170.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -61.06 -31.65 71.3 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 121.152 -0.219 . . . . 0.0 110.975 -175.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 24.4 m -66.46 -46.39 76.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.875 0.369 . . . . 0.0 110.801 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 47' ' ' LEU . 38.3 t -71.38 -52.73 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.626 -176.212 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.622 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 5.0 p -60.2 -34.97 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.871 -175.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.36 -51.52 59.88 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 120.94 0.4 . . . . 0.0 111.267 177.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -69.68 -37.46 76.67 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.578 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.542 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 1.6 pp -59.81 -30.64 69.06 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.536 177.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -62.86 9.8 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 174.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -56.03 110.18 0.7 Allowed 'General case' 0 C--N 1.348 0.522 0 CA-C-N 120.474 1.488 . . . . 0.0 111.367 -177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -76.48 -14.96 60.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.059 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 8.8 m-90 -88.2 157.95 18.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.169 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 19.2 pttm -87.07 53.6 2.88 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.779 0.8 . . . . 0.0 109.959 175.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.579 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 10.6 t70 -42.78 -45.5 4.84 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 114.124 -1.398 . . . . 0.0 113.818 177.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 18.1 t70 63.04 70.47 0.55 Allowed 'General case' 0 C--N 1.347 0.481 0 CA-C-O 121.639 0.733 . . . . 0.0 109.85 -174.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.579 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 14.9 p90 -109.76 164.05 12.93 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.305 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 38.2 t -84.17 113.91 23.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.417 ' HB3' HG21 ' A' ' 112' ' ' ILE . 38.6 ttm -70.99 104.32 2.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.17 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.2 p -108.22 -18.43 13.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.392 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -92.15 139.68 30.39 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 121.94 0.876 . . . . 0.0 111.382 -179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.556 ' HA ' ' HG2' ' A' ' 109' ' ' MET . 6.7 mpt_? -70.72 -32.65 69.91 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.898 -1.501 . . . . 0.0 110.608 -171.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.643 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.3 mm? -73.62 -15.07 61.27 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.968 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.409 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.64 -61.03 2.09 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -177.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.618 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.11 -48.01 3.48 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.079 -0.964 . . . . 0.0 114.586 168.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.7 m -66.15 -42.66 88.72 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.495 1.148 . . . . 0.0 111.56 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -62.94 -23.14 67.25 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.2 mm -55.79 -38.35 51.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.053 0.454 . . . . 0.0 110.329 177.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -131.27 81.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 122.214 1.007 . . . . 0.0 110.142 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.5 t -114.58 -47.19 2.92 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.706 -176.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.468 ' O ' HD23 ' A' ' 59' ' ' LEU . 1.0 OUTLIER -64.33 -68.02 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.016 0.436 . . . . 0.0 111.195 -172.208 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.55 -10.46 59.45 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.087 0.47 . . . . 0.0 110.612 -172.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.956 HG23 HG11 ' A' ' 61' ' ' VAL . 51.7 m -78.8 -35.8 43.74 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 174.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . 3.1 mtpt -80.64 -17.31 51.65 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.514 176.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.468 HD23 ' O ' ' A' ' 55' ' ' LEU . 3.8 mm? -63.93 -60.16 3.61 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.127 170.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -176.02 116.86 0.13 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.603 0.24 . . . . 0.0 110.848 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.956 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -155.0 31.37 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-O 121.515 0.674 . . . . 0.0 110.501 -178.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.668 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.4 m -107.84 121.65 61.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 O-C-N 121.761 -0.587 . . . . 0.0 111.901 -174.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -76.2 -57.49 1.39 Allowed Pre-proline 0 CA--C 1.535 0.39 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.218 174.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.76 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 65.9 Cg_endo -104.18 -138.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.768 2.979 . . . . 0.0 113.596 -167.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.466 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.8 m-20 -72.2 12.01 0.5 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.895 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.56 -74.59 0.39 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 -177.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.579 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -70.28 153.12 43.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.249 -0.475 . . . . 0.0 110.386 176.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.58 36.69 2.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.384 0.611 . . . . 0.0 110.645 172.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.76 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 8.5 p80 -72.37 79.88 1.02 Allowed 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.535 0.683 . . . . 0.0 111.045 175.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -86.94 -60.38 2.0 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.049 -0.978 . . . . 0.0 112.085 -178.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.78 -62.26 6.3 Favored Glycine 0 CA--C 1.507 -0.453 0 CA-C-N 116.311 -0.404 . . . . 0.0 113.115 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -59.14 -23.54 62.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -177.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.83 -37.09 64.95 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.272 0.558 . . . . 0.0 110.769 178.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.747 ' HE2' HG12 ' A' ' 91' ' ' VAL . 32.0 mmmt -80.3 -32.5 38.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.823 177.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -62.48 -39.9 94.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.685 174.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -63.49 -42.81 98.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.628 175.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -71.04 -37.78 72.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.611 -177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.1 mtm -69.92 -32.13 70.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.601 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.48 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 16.9 tptm -93.25 -10.32 36.01 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 119.922 -0.711 . . . . 0.0 110.822 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.512 ' HB3' HD22 ' A' ' 8' ' ' LEU . 75.7 m-70 -141.96 89.74 2.21 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 122.076 -0.39 . . . . 0.0 110.85 -179.478 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' A' ' 8' ' ' LEU . . . 127.35 -68.17 0.54 Allowed Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.793 174.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.607 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -106.34 140.85 38.62 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.851 -177.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -77.37 159.65 29.35 Favored 'General case' 0 CA--C 1.498 -1.036 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.0 OUTLIER -61.6 -49.83 75.03 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.744 -164.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 7.0 t -60.14 -28.7 68.11 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.959 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 5.7 tpt -79.86 -46.24 17.21 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.48 0.657 . . . . 0.0 109.735 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.65 -35.78 70.98 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.805 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -73.12 -25.17 60.75 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.571 -1.195 . . . . 0.0 111.594 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.0 mm-40 -75.65 -23.54 56.3 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.374 -0.972 . . . . 0.0 108.374 172.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.65 ' O ' HG13 ' A' ' 94' ' ' ILE . 36.3 tp -84.98 -41.98 15.35 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.255 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.747 HG12 ' HE2' ' A' ' 74' ' ' LYS . 35.1 m -57.6 -35.81 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -174.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -66.22 -44.12 84.73 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.232 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.821 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.4 mp -62.11 -44.18 98.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.606 173.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.65 HG13 ' O ' ' A' ' 90' ' ' LEU . 39.2 mt -51.89 -47.06 41.4 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.341 0 CA-C-O 120.716 0.293 . . . . 0.0 110.526 -178.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.7 m170 -70.53 -36.6 73.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.923 0.392 . . . . 0.0 110.641 -175.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.59 -42.32 7.87 Favored Glycine 0 N--CA 1.444 -0.785 0 C-N-CA 119.979 -1.105 . . . . 0.0 112.004 -173.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.629 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.2 m -73.23 -41.44 63.73 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HG2' HG11 ' A' ' 114' ' ' VAL . 24.1 mm-40 -56.68 -38.73 72.66 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 120.55 -0.46 . . . . 0.0 110.45 171.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -69.68 -42.73 73.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.755 0.312 . . . . 0.0 111.661 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.0 m -96.86 8.01 45.34 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.37 149.83 94.11 Favored Pre-proline 0 C--O 1.236 0.367 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.04 164.85 4.48 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.111 2.541 . . . . 0.0 112.265 178.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -69.28 38.63 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.437 2.758 . . . . 0.0 113.212 -179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -99.45 104.98 16.86 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.718 176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -78.83 87.05 4.71 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 175.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.4 t0 -112.05 104.23 12.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.279 -174.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -35.69 -76.09 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 O-C-N 124.595 1.184 . . . . 0.0 113.787 -173.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.1 t -94.99 -15.59 23.41 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.556 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 1.9 mmm -86.02 -22.99 26.98 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -168.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.716 ' HD3' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.57 -38.6 81.58 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 122.069 0.938 . . . . 0.0 110.076 -175.367 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.919 HG22 HD12 ' A' ' 112' ' ' ILE . 0.6 OUTLIER -56.27 -16.86 6.1 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 114.101 -1.409 . . . . 0.0 112.291 174.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.919 HD12 HG22 ' A' ' 111' ' ' THR . 1.8 mp -91.17 -36.74 8.38 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -58.72 -37.1 75.42 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.199 176.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.616 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 4.8 m -80.71 -32.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 CA-C-O 121.656 0.741 . . . . 0.0 109.971 -178.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.57 -48.93 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.746 174.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.0 ptt? -69.18 -13.65 62.53 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.366 177.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.93 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 52.5 t -73.64 -31.75 63.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.758 173.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.821 ' HB2' HG21 ' A' ' 93' ' ' ILE . 74.2 t80 -74.17 -47.1 38.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.173 177.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.467 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.45 -23.99 63.74 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 118.492 -1.283 . . . . 0.0 110.163 -178.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.93 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 25.0 ttpt -56.73 -54.09 50.23 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.017 0.437 . . . . 0.0 110.314 166.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -58.73 -48.81 79.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.539 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.467 HG22 ' HA ' ' A' ' 119' ' ' LYS . 10.7 tt -58.44 -30.13 40.05 Favored 'Isoleucine or valine' 0 C--N 1.341 0.212 0 CA-C-N 118.361 0.528 . . . . 0.0 110.762 178.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -71.28 -32.52 68.77 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.682 ' HE3' ' HA ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -68.82 -33.72 74.3 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.433 0.635 . . . . 0.0 109.783 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.9 -36.97 84.86 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.516 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 64.64 -79.25 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.327 0.651 . . . . 0.0 111.828 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . 0.445 ' HD1' ' H ' ' A' ' 127' ' ' TRP . 3.0 p-90 -93.71 -171.83 2.71 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.595 -176.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.6 p -99.4 126.06 38.96 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.766 0.317 . . . . 0.0 111.006 -178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.92 161.38 18.94 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.887 2.391 . . . . 0.0 112.582 178.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.57 133.76 34.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.932 -176.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.95 160.4 14.41 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.045 177.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -94.26 159.42 15.14 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 54.8 tp -119.51 123.19 43.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.949 0.404 . . . . 0.0 111.632 -174.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 2.8 m -78.15 119.61 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.071 172.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.423 HD13 ' HA ' ' A' ' 135' ' ' ILE . 11.3 mm -88.35 116.79 30.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.9 0.381 . . . . 0.0 110.162 178.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -98.49 112.81 4.56 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.924 178.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -83.37 99.14 9.86 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 41.8 t -100.54 108.65 23.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.988 -176.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 63.7 tp -148.69 93.6 2.15 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.987 174.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -104.7 16.32 26.24 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.504 0.668 . . . . 0.0 109.967 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.505 ' HG3' HG23 ' A' ' 142' ' ' VAL . 7.8 tp10 -104.57 135.87 45.18 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.868 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.505 HG23 ' HG3' ' A' ' 141' ' ' GLU . 41.5 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.412 -178.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.462 ' HA ' ' OD1' ' A' ' 132' ' ' ASP . 32.2 p . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.577 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 36.9 Cg_exo -60.54 -21.42 68.48 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.987 2.458 . . . . 0.0 112.761 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -50.79 -70.8 0.08 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.851 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 16.2 tt -83.16 -9.85 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.345 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.577 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.1 ttt -66.32 -28.66 68.85 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.244 0.545 . . . . 0.0 109.887 178.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.1 mmtt -83.6 100.24 10.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.754 172.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.567 ' HB2' HD22 ' A' ' 10' ' ' ASN . 17.5 m120 -61.8 137.8 58.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.524 -178.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 77.2 mt -54.18 -34.53 60.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.201 -178.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 5.6 p -62.16 -40.75 97.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.277 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.567 HD22 ' HB2' ' A' ' 7' ' ' ASN . 56.9 m-80 -77.12 -30.45 55.23 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.061 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -68.21 -55.34 12.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -57.56 -82.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.173 170.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 51.19 36.35 35.93 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.804 178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -69.37 -49.62 53.82 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 117.198 0.499 . . . . 0.0 110.383 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -153.8 105.39 2.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.488 178.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 54.7 ttp -75.47 -21.78 57.79 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.254 0.55 . . . . 0.0 110.194 178.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -63.03 -23.91 67.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.716 -176.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.683 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 21.0 pt20 -84.56 -25.69 28.52 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.335 -176.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.0 m -75.25 -35.45 61.39 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.513 ' HD3' ' HB2' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -63.09 -49.5 74.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.209 -178.096 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -70.62 -43.09 69.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.424 -179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.683 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.5 tm-20 -62.0 -44.29 97.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.966 -175.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.448 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 15.2 mt -81.98 -13.65 57.14 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.637 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.0 m 57.64 38.36 27.69 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.091 -174.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.605 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 19.2 mt -51.01 120.94 14.66 Favored Pre-proline 0 N--CA 1.465 0.325 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.093 -174.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.519 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 17.3 Cg_exo -69.05 154.46 70.53 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.165 1.91 . . . . 0.0 111.036 174.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.637 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.3 p-10 -65.63 -27.34 68.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.678 -176.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 t -64.64 -40.52 95.59 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 109.566 174.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.558 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.3 t -72.85 -50.1 35.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.234 -177.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.8 m -54.98 -30.75 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 120.876 0.369 . . . . 0.0 110.21 176.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.21 -51.53 63.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.554 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -70.62 -39.22 73.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.453 0.644 . . . . 0.0 109.748 178.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 2.7 tm? -51.25 -54.35 26.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.576 176.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -64.24 9.66 0.07 Allowed 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -66.67 104.27 1.26 Allowed 'General case' 0 C--N 1.345 0.404 0 CA-C-N 120.332 1.423 . . . . 0.0 109.483 176.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -86.49 -20.16 28.49 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.512 -170.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.7 m-90 -90.27 142.32 27.84 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.439 0.638 . . . . 0.0 110.894 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.665 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -80.64 65.73 5.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.092 -171.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -62.39 -27.4 69.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.656 170.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.5 t70 63.09 70.66 0.54 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.593 0.711 . . . . 0.0 109.563 -172.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 18.4 p90 -95.63 163.15 13.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.082 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.8 t -87.97 121.64 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 174.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.552 ' O ' HG21 ' A' ' 112' ' ' ILE . 43.4 tpp -76.45 104.68 7.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.474 -178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.2 p -110.13 -4.79 15.59 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 119.75 -0.78 . . . . 0.0 112.76 179.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -96.4 131.45 42.94 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 110.443 178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.477 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 8.8 mpt_? -73.02 -23.9 60.67 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.87 -171.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.605 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.8 mm? -78.16 -18.12 55.95 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.055 0.455 . . . . 0.0 109.928 -177.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.539 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -85.16 -55.81 3.86 Favored 'General case' 0 N--CA 1.441 -0.884 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -175.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.44 -48.32 2.94 Favored Glycine 0 CA--C 1.531 1.049 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.939 165.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 13.7 m -64.12 -42.02 97.01 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 118.143 0.971 . . . . 0.0 111.667 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -65.71 -22.61 66.63 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.539 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.1 mm -63.77 -29.74 48.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 120.963 0.411 . . . . 0.0 111.34 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -135.8 44.49 2.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.933 0.397 . . . . 0.0 111.362 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.552 ' SG ' HD12 ' A' ' 55' ' ' LEU . 24.6 p -94.27 -36.15 12.12 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -177.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.552 HD12 ' SG ' ' A' ' 54' ' ' CYS . 8.6 mp -56.41 -69.67 0.14 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -170.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.477 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.75 -8.8 59.73 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.061 0.458 . . . . 0.0 110.777 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.609 ' HA ' HG11 ' A' ' 61' ' ' VAL . 55.8 m -80.47 -35.16 35.23 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.297 176.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HE2' ' HG3' ' A' ' 22' ' ' GLU . 16.9 mmmt -77.64 -21.84 51.63 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.4 173.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.9 mt -65.05 -65.84 0.62 Allowed 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.814 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -176.16 119.76 0.15 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.609 HG11 ' HA ' ' A' ' 57' ' ' THR . 10.6 p -178.4 34.04 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 121.613 0.72 . . . . 0.0 111.13 -177.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.68 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.7 m -102.24 118.78 49.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 O-C-N 120.953 -1.092 . . . . 0.0 111.256 -173.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.16 -56.01 14.33 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 115.927 -0.579 . . . . 0.0 112.265 179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.611 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 8.7 Cg_endo -95.01 -139.64 0.02 OUTLIER 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 123.009 2.473 . . . . 0.0 112.854 -171.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.45 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 3.8 m-20 -76.27 11.18 1.63 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.587 -176.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.8 -75.41 0.4 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.523 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.648 HD22 HD23 ' A' ' 68' ' ' LEU . 1.9 p-10 -75.33 159.3 31.62 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.03 -0.585 . . . . 0.0 111.158 179.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.648 HD23 HD22 ' A' ' 67' ' ' ASN . 4.6 mm? 68.95 43.24 1.18 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.255 0.55 . . . . 0.0 111.967 174.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.68 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 6.7 p80 -83.34 76.0 9.94 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.476 0.655 . . . . 0.0 110.693 177.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -86.86 -61.93 1.62 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.814 -176.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.15 -52.8 51.2 Favored Glycine 0 CA--C 1.508 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 112.619 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -56.94 -34.68 68.23 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.286 . . . . 0.0 111.579 -179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.12 -36.15 74.6 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-O 121.184 0.516 . . . . 0.0 111.224 -178.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 74' ' ' LYS . 21.1 mmmt -79.82 -35.18 38.78 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 33.3 t70 -64.18 -35.44 80.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.648 173.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.508 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 52.0 t80 -62.26 -35.27 78.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.485 176.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.33 -33.21 72.79 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.856 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 66.1 mtt -68.2 -39.05 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.639 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.65 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 34.3 pttt -93.29 -5.95 48.58 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.699 -0.401 . . . . 0.0 111.227 -178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.65 ' CD2' ' HG3' ' A' ' 79' ' ' LYS . 66.6 m-70 -136.06 88.9 2.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.629 0.252 . . . . 0.0 110.75 175.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.22 -75.09 0.36 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.802 172.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -99.56 132.59 44.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.896 0.379 . . . . 0.0 111.331 -174.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.481 ' OD2' HG22 ' A' ' 85' ' ' THR . 6.5 p-10 -79.21 172.36 13.91 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -55.62 -45.68 77.48 Favored 'General case' 0 N--CA 1.427 -1.593 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -164.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.743 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 11.3 t -53.66 -40.69 66.1 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 58.9 mtm -82.24 -38.22 24.81 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.111 0.482 . . . . 0.0 109.701 -174.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.487 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.67 -37.58 76.32 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.165 172.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.561 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.76 -24.93 59.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.997 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.743 ' HG2' ' O ' ' A' ' 85' ' ' THR . 66.0 mm-40 -77.88 -23.49 48.77 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 174.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 64.1 tp -88.3 -48.26 7.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.293 -178.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.561 HG22 ' HA ' ' A' ' 88' ' ' GLN . 17.1 m -57.22 -38.13 59.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -172.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -68.14 -43.38 78.45 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-O 121.389 0.614 . . . . 0.0 110.363 -175.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.702 HG23 ' HB2' ' A' ' 117' ' ' CYS . 1.7 mp -61.8 -43.01 96.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.713 179.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.6 mt -55.64 -47.05 79.47 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.313 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.223 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -65.67 -34.71 78.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.505 -175.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.71 -60.19 2.23 Favored Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.389 -169.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.792 ' SG ' ' HA ' ' A' ' 114' ' ' VAL . 8.8 p -74.01 -27.31 60.9 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.041 -177.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.529 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.1 tm-20 -65.27 -38.25 89.71 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 118.576 -1.25 . . . . 0.0 109.783 171.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -64.74 -43.29 93.82 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.878 176.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 55.5 m -103.54 26.12 8.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.912 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.62 155.61 92.57 Favored Pre-proline 0 C--O 1.235 0.328 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 174.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' A' ' 104' ' ' ASN . 53.3 Cg_exo -53.69 164.99 1.95 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.003 2.468 . . . . 0.0 112.482 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.79 31.24 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.499 2.799 . . . . 0.0 113.169 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 102' ' ' PRO . 4.6 m-20 -122.17 94.79 4.41 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.578 176.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -71.38 92.88 1.1 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 176.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.415 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 1.2 t70 -91.01 104.59 17.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.324 -176.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.42 ' O ' ' HD2' ' A' ' 110' ' ' LYS . 18.1 tttp -34.73 -74.35 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -167.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 27.7 t -90.82 -9.72 45.41 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.846 -0.533 . . . . 0.0 111.294 -179.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.415 ' HB2' ' OD1' ' A' ' 106' ' ' ASP . 3.0 mmm -87.74 -22.04 24.82 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -168.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.582 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -55.12 -45.85 75.57 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.703 0.763 . . . . 0.0 110.82 -173.196 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.646 HG22 HD12 ' A' ' 112' ' ' ILE . 0.4 OUTLIER -53.97 -14.91 1.15 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.114 -1.403 . . . . 0.0 113.112 177.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.646 HD12 HG22 ' A' ' 111' ' ' THR . 1.7 mp -92.02 -39.06 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -58.42 -38.48 77.51 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 175.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.849 ' HA ' ' SG ' ' A' ' 117' ' ' CYS . 3.6 m -82.5 -34.07 11.62 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 CA-C-O 122.2 1.0 . . . . 0.0 110.347 -176.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.74 -43.38 90.22 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.72 173.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.588 ' HB2' ' HE2' ' A' ' 119' ' ' LYS . 22.5 ptt? -68.36 -20.01 64.68 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 119.301 -0.96 . . . . 0.0 112.111 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.864 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 1.4 m -66.85 -30.5 70.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 118.844 0.747 . . . . 0.0 109.228 170.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -72.05 -46.36 57.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.605 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.588 ' HE2' ' HB2' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.58 -21.97 62.62 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 118.863 -1.135 . . . . 0.0 110.57 177.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.864 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.22 -48.87 77.72 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 169.245 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -58.4 -52.12 66.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.09 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -56.95 -35.68 47.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 CA-C-N 117.726 0.239 . . . . 0.0 110.906 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 6.7 m170 -72.72 -17.57 61.6 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 175.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.1 tppt? -79.07 -35.02 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 122.022 -0.424 . . . . 0.0 110.576 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 82.2 mt -73.23 -39.56 65.38 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 59.9 m-80 54.6 -90.7 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -61.69 103.68 0.36 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.017 -0.992 . . . . 0.0 112.994 -170.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.426 ' HB ' ' HB2' ' A' ' 131' ' ' MET . 6.8 m -124.11 100.46 36.33 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.387 171.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_endo -61.54 -85.99 0.01 OUTLIER 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.929 2.419 . . . . 0.0 113.638 -172.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -110.21 28.19 8.87 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.234 0.54 . . . . 0.0 110.259 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.426 ' HB2' ' HB ' ' A' ' 128' ' ' VAL . 84.6 mtp -80.53 54.67 2.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.942 177.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.462 ' OD1' ' HA ' ' A' ' 1' ' ' SER . 19.2 t70 -148.99 105.27 3.52 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.795 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.439 ' O ' ' HD2' ' A' ' 2' ' ' PRO . 60.3 tp -79.93 86.77 5.41 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.214 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 7.2 p -73.2 142.0 15.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.833 -0.622 . . . . 0.0 110.391 177.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.4 mm -109.77 126.35 66.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.005 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -102.46 135.62 12.37 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.846 -0.692 . . . . 0.0 111.907 -178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -77.82 138.09 38.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.889 0.376 . . . . 0.0 111.061 -178.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 57.7 t -94.8 131.85 40.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.745 ' H ' HD23 ' A' ' 139' ' ' LEU . 2.6 pt? -92.29 148.57 22.03 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.2 0.524 . . . . 0.0 111.68 -174.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -104.53 -76.17 0.6 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 170.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 67.88 156.4 0.12 Allowed 'General case' 0 CA--C 1.535 0.393 0 O-C-N 123.958 0.787 . . . . 0.0 112.671 167.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 4.7 p . . . . . 0 C--O 1.25 1.087 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.515 179.045 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.477 0.902 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -89.13 6.1 4.68 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 122.769 2.312 . . . . 0.0 113.243 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -51.62 -74.17 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -178.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.726 HD11 ' HB2' ' A' ' 82' ' ' ALA . 27.3 mm -91.03 -16.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.005 0.431 . . . . 0.0 111.89 177.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.5 tpt -69.73 -34.81 74.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -100.27 105.32 16.86 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 174.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 9' ' ' SER . 6.1 t-20 -61.55 112.57 2.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.868 -174.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.598 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 pt? -64.57 -23.22 67.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.433 -178.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.435 ' HB2' ' OD1' ' A' ' 7' ' ' ASN . 14.4 m -63.65 -40.23 96.34 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.057 0.456 . . . . 0.0 109.84 175.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.95 -30.14 58.55 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.363 177.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.64 -51.97 43.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 178.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -56.44 -79.48 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.642 170.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.81 39.85 40.38 Favored Glycine 0 C--N 1.346 1.137 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.338 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -62.79 -42.45 99.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.863 0.332 . . . . 0.0 111.665 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.764 ' H ' HD21 ' A' ' 55' ' ' LEU . . . -144.55 105.01 4.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.059 0.456 . . . . 0.0 111.403 -177.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 49.8 ttm -75.45 -42.11 54.11 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.263 0.554 . . . . 0.0 110.76 -179.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -63.36 -22.66 67.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.644 -175.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -88.0 -25.37 23.17 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.92 -175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.413 ' O ' HD23 ' A' ' 23' ' ' LEU . 14.7 m -71.91 -33.85 68.63 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 170.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.498 ' HA ' HD12 ' A' ' 25' ' ' LEU . 48.8 tptt -58.88 -55.28 37.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.911 175.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.1 -44.45 65.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.162 -0.472 . . . . 0.0 112.039 -174.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 19.6 tp10 -64.59 -39.27 93.43 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.728 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 4.4 mm? -82.43 -19.71 38.44 Favored 'General case' 0 CA--C 1.514 -0.435 0 O-C-N 122.213 -0.305 . . . . 0.0 110.479 178.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.1 m 61.63 46.76 6.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -168.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.728 ' HG ' ' HB2' ' A' ' 23' ' ' LEU . 20.5 mt -62.72 121.59 68.91 Favored Pre-proline 0 N--CA 1.453 -0.32 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.067 -170.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.615 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 24.0 Cg_exo -61.54 149.67 88.72 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.115 1.877 . . . . 0.0 110.427 176.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -59.97 -35.16 74.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.744 0.306 . . . . 0.0 110.973 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.3 m -69.16 -39.4 78.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.507 179.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 80.7 t -74.23 -52.97 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.719 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.9 p -57.53 -37.02 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.175 0.512 . . . . 0.0 110.273 -176.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.4 -51.33 61.08 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.221 177.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -71.78 -23.46 61.58 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.054 0.455 . . . . 0.0 110.716 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.63 -50.75 69.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 169.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.462 ' CE2' HG22 ' A' ' 30' ' ' VAL . 10.0 m-85 -77.28 10.61 2.36 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 179.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -57.54 130.49 46.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 -178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -72.46 -37.18 68.58 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -171.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 45.1 p90 -92.34 131.69 37.33 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.415 178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' H ' ' HG2' ' A' ' 38' ' ' LYS . 0.4 OUTLIER -89.38 73.31 7.95 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.546 0.689 . . . . 0.0 110.57 -178.129 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.491 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 36.3 t70 -42.7 -33.32 0.71 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.7 t0 67.2 51.27 0.93 Allowed 'General case' 0 C--N 1.348 0.531 0 CA-C-O 122.186 0.993 . . . . 0.0 109.715 -175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.491 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -91.62 178.03 6.04 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.159 174.431 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.533 ' O ' HG23 ' A' ' 44' ' ' THR . 25.7 t -83.33 117.93 30.01 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.797 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 29.4 ttp -67.65 92.85 0.34 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.185 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.533 HG23 ' O ' ' A' ' 42' ' ' VAL . 66.5 p -95.91 -8.78 33.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.527 -174.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 10.7 t70 -97.08 134.58 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.267 0.556 . . . . 0.0 111.503 179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.613 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 6.2 mpt_? -76.31 -21.1 56.63 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.119 -174.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.615 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 3.9 mm? -79.64 -15.23 57.99 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.212 -176.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.41 -61.87 1.73 Allowed 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -176.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.69 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -42.45 -48.01 5.75 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.402 168.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.8 m -67.27 -44.46 79.26 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.581 1.191 . . . . 0.0 111.823 -179.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.98 -2.42 36.95 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 122.015 -0.428 . . . . 0.0 111.701 -175.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.92 -29.37 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 173.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.424 ' O ' ' HB ' ' A' ' 57' ' ' THR . 23.3 t-20 -146.25 70.81 1.23 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 121.406 0.622 . . . . 0.0 110.707 175.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 58' ' ' LYS . 8.9 p -98.36 -41.77 7.68 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.901 174.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.764 HD21 ' H ' ' A' ' 15' ' ' ALA . 1.7 tm? -55.87 -66.0 0.5 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.057 0.456 . . . . 0.0 111.068 -176.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -82.75 -16.38 48.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.584 -169.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.43 HG23 ' CG2' ' A' ' 61' ' ' VAL . 23.7 m -84.16 -39.62 19.19 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.788 174.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.688 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 22.8 mmtt -81.62 -2.55 50.6 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.063 -0.398 . . . . 0.0 111.567 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 9.8 mt -64.99 -67.65 0.42 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.505 166.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -178.9 101.33 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 O-C-N 123.114 0.259 . . . . 0.0 110.978 176.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.43 ' CG2' HG23 ' A' ' 57' ' ' THR . 30.4 m -148.95 50.22 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-O 121.35 0.595 . . . . 0.0 111.169 178.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.644 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 5.9 m -99.9 120.58 49.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.85 -0.531 . . . . 0.0 110.915 -176.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' H ' ' HB2' ' A' ' 69' ' ' HIS . 1.8 t70 -75.2 -57.73 1.66 Allowed Pre-proline 0 CA--C 1.533 0.293 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.639 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 19.4 Cg_endo -98.68 -139.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.237 2.624 . . . . 0.0 113.058 -168.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 4.0 m-20 -72.63 10.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.244 -176.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.81 -70.02 0.52 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.808 HD22 HD23 ' A' ' 68' ' ' LEU . 2.5 p-10 -75.09 154.43 37.86 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.86 -0.67 . . . . 0.0 111.468 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.808 HD23 HD22 ' A' ' 67' ' ' ASN . 4.6 mm? 68.99 33.78 3.34 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.695 172.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.1 p80 -79.68 69.87 6.07 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.914 178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.576 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 2.5 p-80 -85.67 -33.24 21.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.249 177.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.41 -62.84 4.75 Favored Glycine 0 CA--C 1.511 -0.216 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.382 -177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.45 ' H ' ' HB2' ' A' ' 63' ' ' ASP . 11.1 t-20 -57.52 -30.49 65.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.61 -0.295 . . . . 0.0 111.532 -178.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.73 -36.39 65.18 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.178 0.514 . . . . 0.0 111.372 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.576 ' HG2' ' O ' ' A' ' 70' ' ' HIS . 24.4 mmmt -80.37 -35.03 35.96 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 -179.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.18 -38.8 90.44 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 172.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.619 ' CZ ' ' HB1' ' A' ' 56' ' ' ALA . 48.8 t80 -56.11 -43.42 78.12 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.923 175.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.55 -34.02 71.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.969 0.414 . . . . 0.0 111.212 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 67.0 mtt -74.6 -34.86 62.93 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.669 -179.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.915 ' HE2' ' HA ' ' A' ' 79' ' ' LYS . 9.5 mmpt? -91.37 -10.13 42.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.551 -0.459 . . . . 0.0 111.138 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -143.5 93.87 2.53 Favored 'General case' 0 C--O 1.227 -0.102 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 128.83 -75.5 0.42 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.543 174.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.726 ' HB2' HD11 ' A' ' 4' ' ' ILE . . . -98.36 151.41 20.56 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.537 0.208 . . . . 0.0 110.743 -177.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.585 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.4 p-10 -91.84 172.95 8.12 Favored 'General case' 0 CA--C 1.502 -0.877 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -58.04 -38.08 75.6 Favored 'General case' 0 N--CA 1.418 -2.051 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -170.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.701 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 8.0 t -62.44 -35.95 80.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.526 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.438 ' O ' HD13 ' A' ' 90' ' ' LEU . 59.1 mtp -83.05 -39.12 21.63 Favored 'General case' 0 CA--C 1.508 -0.642 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 -176.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.53 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.63 -34.41 72.76 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.59 174.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.791 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.36 -23.61 54.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.484 -179.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.8 mm-40 -77.81 -25.04 48.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 174.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.519 ' O ' HG13 ' A' ' 94' ' ' ILE . 10.8 mp -85.37 -46.26 11.11 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.409 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.791 HG22 ' HA ' ' A' ' 88' ' ' GLN . 6.3 m -58.62 -32.33 45.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -177.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -68.38 -44.46 75.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.959 0.409 . . . . 0.0 110.184 -176.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.721 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.7 mp -68.76 -41.97 82.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.274 177.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 90' ' ' LEU . 65.3 mt -56.98 -49.26 79.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.942 0.401 . . . . 0.0 110.026 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 44.8 m170 -72.52 -36.36 68.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.276 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.44 -45.96 5.97 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.051 -172.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.571 ' SG ' HG23 ' A' ' 93' ' ' ILE . 83.5 m -70.74 -39.86 73.06 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.878 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.497 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 2.6 tm-20 -63.34 -38.23 90.36 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 118.222 0.465 . . . . 0.0 110.449 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -68.22 -36.04 78.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.848 0.356 . . . . 0.0 110.939 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.3 m -96.69 7.79 45.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 111.272 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.19 144.6 84.82 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.1 -176.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 35.4 Cg_exo -61.14 146.12 97.95 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.347 2.032 . . . . 0.0 110.124 174.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 37.9 Cg_exo -57.07 91.14 0.05 OUTLIER 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 122.967 2.445 . . . . 0.0 113.256 -176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -125.97 93.47 3.83 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 175.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -81.3 63.45 5.63 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 0.0 110.927 -175.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.778 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 13.3 t70 -124.18 112.36 16.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.213 172.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -34.09 -55.0 0.5 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.7 t -88.19 -30.55 19.66 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 119.032 0.833 . . . . 0.0 112.294 -174.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.778 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 73.2 mmm -65.28 -36.25 83.5 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -175.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.622 ' HG3' ' H ' ' A' ' 111' ' ' THR . 5.6 ptpt -57.79 -48.39 79.83 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.818 0.818 . . . . 0.0 110.346 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.622 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.4 OUTLIER -57.46 -10.66 1.52 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.553 -1.203 . . . . 0.0 112.602 174.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.69 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.1 mp -89.84 -41.36 13.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 4.4 m-20 -59.66 -35.49 74.53 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.362 174.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.581 HG22 ' HA ' ' A' ' 111' ' ' THR . 7.1 m -80.76 -35.49 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.046 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.41 -51.57 68.92 Favored 'General case' 0 C--O 1.244 0.793 0 CA-C-O 121.337 0.589 . . . . 0.0 111.472 177.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.701 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.97 -25.17 64.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.179 -0.609 . . . . 0.0 110.251 179.538 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 48.5 t -68.57 -27.03 65.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.745 175.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.721 ' HB2' HG21 ' A' ' 93' ' ' ILE . 66.3 t80 -74.36 -44.31 52.79 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.285 179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.567 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 1.2 pttp -70.49 -29.72 66.32 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.174 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.701 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.34 -56.18 23.01 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.958 0.409 . . . . 0.0 110.322 169.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -61.95 -42.28 98.93 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 175.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.1 -33.67 43.38 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 118.488 0.586 . . . . 0.0 111.078 175.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 9.8 m170 -71.59 -32.22 67.8 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 122.244 -0.285 . . . . 0.0 111.659 174.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.2 tttt -68.56 -35.84 77.95 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.317 0.58 . . . . 0.0 110.116 176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 81.7 mt -76.55 -0.48 23.36 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.431 173.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.401 ' N ' HD22 ' A' ' 126' ' ' ASN . 0.9 OUTLIER 65.12 177.06 0.2 Allowed 'General case' 0 C--O 1.231 0.099 0 CA-C-O 121.469 0.652 . . . . 0.0 111.596 -177.506 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -110.48 120.38 42.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.873 -170.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 47.1 t -94.39 116.23 66.17 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.292 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -63.69 137.56 59.55 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.736 2.291 . . . . 0.0 112.488 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -88.07 136.84 32.79 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 70.1 mtm -68.02 -41.91 81.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.504 0.192 . . . . 0.0 111.011 -174.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 62.83 -178.34 0.14 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 123.871 0.732 . . . . 0.0 111.858 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.533 HD13 ' N ' ' A' ' 134' ' ' VAL . 1.3 tm? 178.59 147.67 0.18 Allowed 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.533 ' N ' HD13 ' A' ' 133' ' ' LEU . 5.6 p -56.15 101.81 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.56 0.695 . . . . 0.0 110.561 177.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.689 HD13 ' H ' ' A' ' 135' ' ' ILE . 0.2 OUTLIER -71.62 18.1 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.669 -176.478 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.414 ' H ' HG22 ' A' ' 134' ' ' VAL . . . 95.27 89.95 1.74 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.793 178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -64.61 133.09 51.53 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 171.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 51.2 t -44.82 120.61 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 O-C-N 123.969 0.793 . . . . 0.0 111.857 -172.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.9 mt -78.87 139.2 38.37 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.145 -179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -148.64 140.06 23.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.659 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 13.6 mp0 -82.55 -47.31 12.3 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.275 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.111 179.79 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 110.723 -0.103 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.97 -22.55 55.31 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.461 2.107 . . . . 0.0 111.348 177.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.46 -65.98 0.47 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.289 178.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.422 HD12 ' HA ' ' A' ' 4' ' ' ILE . 9.2 tp -72.46 -15.2 17.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 CA-C-O 121.126 0.489 . . . . 0.0 111.188 178.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 18.2 ttt -71.22 -24.94 62.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.91 -178.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -100.33 94.08 6.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.908 174.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -64.12 138.93 58.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.278 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mp -57.7 -43.07 84.89 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.755 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.4 m -62.3 -36.56 82.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.87 179.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.98 -36.88 62.01 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.011 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -68.93 -55.82 9.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.956 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -48.97 -72.41 0.05 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.009 -0.542 . . . . 0.0 112.24 170.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.36 29.61 46.86 Favored Glycine 0 C--N 1.347 1.141 0 C-N-CA 121.039 -0.6 . . . . 0.0 113.772 -177.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.449 ' H ' HD11 ' A' ' 55' ' ' LEU . 64.8 tttm -85.89 -37.26 19.32 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 117.14 0.47 . . . . 0.0 110.718 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.589 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.38 56.16 1.29 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.088 0.471 . . . . 0.0 111.314 -177.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.1 ttm -72.38 -38.48 68.49 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.155 0.502 . . . . 0.0 110.12 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -60.72 -34.43 74.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.905 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -90.42 -25.35 20.41 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.53 -170.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 12.3 p -74.95 -33.0 61.87 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 173.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.824 ' HA ' HD22 ' A' ' 25' ' ' LEU . 9.9 tptm -57.11 -50.86 71.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.611 172.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -70.3 -42.65 71.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -65.44 -36.04 82.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.538 0.209 . . . . 0.0 111.339 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.604 HD13 ' HB3' ' A' ' 50' ' ' CYS . 11.3 mt -81.03 -3.75 52.86 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.166 0.507 . . . . 0.0 110.753 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.1 t 65.45 27.83 11.7 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.028 -0.987 . . . . 0.0 110.811 178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.824 HD22 ' HA ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -55.01 119.86 25.34 Favored Pre-proline 0 N--CA 1.466 0.351 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.012 176.506 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -75.01 156.86 42.98 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.774 2.316 . . . . 0.0 111.435 174.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.67 ' HA ' HG22 ' A' ' 30' ' ' VAL . 12.6 p-10 -66.73 -22.59 66.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.17 -175.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.7 p -68.48 -39.76 81.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.303 0.573 . . . . 0.0 110.761 175.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.35 -50.87 42.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.379 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 27' ' ' ASP . 17.3 m -58.9 -33.6 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.393 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -50.45 67.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.499 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -64.43 -37.14 86.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.313 0.577 . . . . 0.0 110.01 179.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mt -57.91 -54.83 42.53 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.056 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -74.88 8.99 2.09 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -176.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -63.24 130.96 46.77 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 118.349 0.522 . . . . 0.0 110.771 -178.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -74.47 -31.68 62.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.142 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m-90 -81.23 118.0 22.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.778 -177.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.518 ' O ' ' HD3' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -81.44 72.95 8.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.351 0.596 . . . . 0.0 111.754 -177.207 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.531 ' HB3' ' CD2' ' A' ' 41' ' ' TYR . 18.7 t70 -44.94 -44.64 9.94 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 173.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.51 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 20.6 m-20 75.01 70.9 0.09 Allowed 'General case' 0 C--N 1.35 0.607 0 CA-C-O 121.522 0.677 . . . . 0.0 110.489 -175.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.531 ' CD2' ' HB3' ' A' ' 39' ' ' ASP . 9.1 p90 -117.73 176.68 5.07 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.455 -177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 44' ' ' THR . 6.2 t -92.16 121.06 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.444 ' O ' HG21 ' A' ' 112' ' ' ILE . 41.6 ttm -62.25 100.93 0.19 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.519 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.489 HG23 ' O ' ' A' ' 42' ' ' VAL . 67.9 p -99.32 -23.64 15.1 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.58 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -83.82 134.21 34.72 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.5 0.667 . . . . 0.0 111.484 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.795 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 9.5 mpt_? -74.88 -21.87 58.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.465 -175.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.462 ' HB3' HD12 ' A' ' 25' ' ' LEU . 2.7 mm? -79.5 -13.04 59.83 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 -177.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.455 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -61.69 1.89 Allowed 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 -178.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -41.07 -48.48 4.34 Favored Glycine 0 CA--C 1.53 1.015 0 CA-C-N 114.901 -1.045 . . . . 0.0 114.293 169.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.604 ' HB3' HD13 ' A' ' 23' ' ' LEU . 15.4 m -68.75 -38.86 80.42 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.49 1.145 . . . . 0.0 111.947 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.31 -23.97 67.49 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 48' ' ' ALA . 70.1 mt -61.96 -37.34 78.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-O 121.264 0.554 . . . . 0.0 110.622 177.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.491 HD22 ' N ' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -132.88 85.47 2.22 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.803 0.811 . . . . 0.0 110.076 -178.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . 24.4 p -119.01 -46.34 2.53 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.504 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.589 HD11 ' H ' ' A' ' 15' ' ' ALA . 1.5 tt -58.76 -67.07 0.4 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.041 0.448 . . . . 0.0 111.382 -171.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.565 ' HA ' HD12 ' A' ' 59' ' ' LEU . . . -82.04 -14.72 55.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.88 0.371 . . . . 0.0 110.889 -173.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.486 HG23 HG11 ' A' ' 61' ' ' VAL . 1.4 m -83.04 -35.39 25.8 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.527 ' NZ ' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.56 -16.31 49.02 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.199 -0.601 . . . . 0.0 110.069 174.373 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 56' ' ' ALA . 24.9 mt -64.63 -64.99 0.74 Allowed 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 121.164 -0.215 . . . . 0.0 111.206 172.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -174.61 126.2 0.31 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.568 0.223 . . . . 0.0 110.607 -177.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.486 HG11 HG23 ' A' ' 57' ' ' THR . 14.6 p 179.89 38.19 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 122.348 1.07 . . . . 0.0 109.193 -173.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.693 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 25.2 m -105.17 118.56 52.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.198 -172.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -69.37 -56.01 8.96 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.534 175.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.7 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.3 Cg_endo -98.28 -142.31 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.025 0 C-N-CA 123.537 2.825 . . . . 0.0 113.524 -172.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.442 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -72.13 -2.98 20.6 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.866 -174.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.58 -66.22 0.46 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -174.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.7 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.1 p-10 -71.37 153.73 42.1 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.683 -0.759 . . . . 0.0 110.842 178.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.464 ' HB2' HD22 ' A' ' 67' ' ' ASN . 0.1 OUTLIER 68.47 32.92 4.26 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.567 169.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.693 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.7 p80 -74.61 69.18 1.72 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.864 0.84 . . . . 0.0 110.841 175.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.514 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 64.2 t60 -86.95 -60.79 1.88 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.858 -176.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.52 -53.45 45.85 Favored Glycine 0 N--CA 1.461 0.365 0 C-N-CA 121.223 -0.513 . . . . 0.0 113.096 -175.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -56.05 -34.05 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.633 0.254 . . . . 0.0 111.484 -178.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.479 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -74.61 -33.95 62.71 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.146 0.498 . . . . 0.0 110.744 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 78' ' ' MET . 23.2 mmmt -79.04 -35.32 42.82 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -64.35 -40.2 95.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.004 174.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -59.7 -36.74 77.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.531 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -36.25 75.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.901 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.64 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 50.8 mtt -67.78 -33.35 74.65 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.958 0.409 . . . . 0.0 110.782 -177.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -91.27 -10.54 41.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.026 -179.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -145.72 94.4 2.49 Favored 'General case' 0 N--CA 1.463 0.191 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.541 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 116.4 -60.92 0.41 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.065 173.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -86.3 147.28 26.14 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.133 -0.534 . . . . 0.0 110.474 -178.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 86' ' ' MET . 3.6 m-20 -75.72 146.92 39.74 Favored 'General case' 0 CA--C 1.499 -1.016 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 173.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.838 ' HG3' HE21 ' A' ' 88' ' ' GLN . 0.2 OUTLIER -67.53 -47.29 70.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -179.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -50.15 -39.67 44.17 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.422 -1.263 . . . . 0.0 111.87 169.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.574 ' HB3' ' HB2' ' A' ' 83' ' ' ASP . 0.8 OUTLIER -82.82 -37.88 23.84 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -173.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.551 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -60.79 -41.03 94.8 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.993 174.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.838 HE21 ' HG3' ' A' ' 84' ' ' GLU . 2.6 mp0 -71.29 -27.21 63.25 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.653 -173.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.469 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -84.77 -22.07 29.75 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 119.974 -0.69 . . . . 0.0 110.742 173.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.7 tt -86.12 -42.53 13.81 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.06 -179.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.478 HG13 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -58.76 -32.98 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 122.944 0.498 . . . . 0.0 111.948 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.73 -42.29 97.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.015 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -62.59 -41.49 92.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.012 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.545 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 34.2 mt -56.94 -47.65 82.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.043 0.449 . . . . 0.0 110.385 -178.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -67.62 -35.98 79.95 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.293 -175.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.2 -46.65 5.8 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.183 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.733 ' HB2' HG12 ' A' ' 114' ' ' VAL . 43.7 m -73.4 -35.2 65.82 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.783 -177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.545 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 6.1 mt-10 -66.12 -37.24 85.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.864 0.756 . . . . 0.0 111.029 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -64.02 -42.24 97.17 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-O 120.869 0.366 . . . . 0.0 110.473 177.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.9 m -100.36 22.62 11.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.208 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.6 156.81 70.47 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.063 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -44.41 141.4 5.22 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.892 2.395 . . . . 0.0 111.819 177.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.02 22.97 0.26 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.872 2.381 . . . . 0.0 113.666 -171.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -115.21 94.14 4.6 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -74.31 97.7 3.07 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.194 -175.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.535 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 8.7 t70 -89.3 115.52 26.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.854 179.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -29.72 -63.35 0.13 Allowed 'General case' 0 CA--C 1.539 0.532 0 O-C-N 125.18 1.55 . . . . 0.0 113.627 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 9.9 t -96.89 -12.84 22.96 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -175.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.795 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 3.1 mmm -86.75 -26.18 24.32 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -170.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.635 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -54.36 -44.89 72.58 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 122.076 0.941 . . . . 0.0 110.852 -171.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.635 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.8 t -57.84 -13.2 3.92 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 113.806 -1.543 . . . . 0.0 113.092 178.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.552 HD12 HG23 ' A' ' 111' ' ' THR . 1.7 mp -91.17 -37.97 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 177.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.48 -38.27 77.26 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.79 175.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.733 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -78.95 -36.28 18.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.106 0 CA-C-O 121.283 0.563 . . . . 0.0 110.265 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.47 -46.83 88.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.645 178.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.656 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 21.9 ptt? -69.57 -17.61 63.57 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.628 176.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.63 -30.1 64.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.756 0.788 . . . . 0.0 109.071 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -82.06 -39.77 22.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.669 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.742 ' HA ' HG22 ' A' ' 122' ' ' ILE . 0.0 OUTLIER -69.6 -24.27 63.64 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 118.833 -1.147 . . . . 0.0 110.279 177.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.656 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -53.16 -54.99 27.71 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.991 160.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -58.54 -49.61 76.78 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 178.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.742 HG22 ' HA ' ' A' ' 119' ' ' LYS . 8.7 tt -57.77 -34.44 47.97 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 O-C-N 122.009 -0.432 . . . . 0.0 110.961 178.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -70.45 -29.5 66.08 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 177.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -63.04 -34.5 77.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 69.3 mt -72.04 -11.24 60.67 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.182 173.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 67.49 -162.84 0.22 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.043 0.537 . . . . 0.0 111.986 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -71.32 97.62 1.62 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.622 -172.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 29.4 m -83.25 140.34 42.25 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.242 -0.435 . . . . 0.0 109.852 173.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 13.6 Cg_exo -69.63 75.83 1.13 Allowed 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 123.057 2.504 . . . . 0.0 112.395 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.632 ' O ' ' HG2' ' A' ' 131' ' ' MET . 0.7 OUTLIER -129.61 110.23 11.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.404 178.316 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.632 ' HG2' ' O ' ' A' ' 130' ' ' ASN . 12.7 ptt? 61.99 156.96 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.631 1.172 . . . . 0.0 112.208 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -92.62 -173.59 3.4 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.415 -175.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -102.31 120.92 41.29 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 8.5 m -88.56 113.52 25.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.161 0.505 . . . . 0.0 111.489 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.1 mp -83.32 90.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 176.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -142.93 69.92 0.42 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.702 -179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -81.79 -76.93 0.23 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 75.9 t 65.51 117.24 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.386 0.612 . . . . 0.0 111.062 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.43 16.62 9.71 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.794 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -153.89 154.99 34.88 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.312 179.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -88.44 165.81 14.65 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 176.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 C--O 1.248 0.987 0 O-C-N 124.572 1.17 . . . . 0.0 112.24 179.54 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -63.59 -21.21 70.39 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.227 2.618 . . . . 0.0 112.512 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.551 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.4 mp0 -49.62 -69.19 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.624 179.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -77.83 -10.7 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 CA-C-O 121.075 0.464 . . . . 0.0 111.215 -179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.503 ' HA ' ' CE ' ' A' ' 5' ' ' MET . 2.6 tpt -65.33 -39.72 92.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.119 0.485 . . . . 0.0 110.065 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.4 mttp -82.41 103.48 12.0 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.743 174.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -63.74 148.43 49.18 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.46 -178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.457 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 9.7 mp -58.92 -52.65 64.85 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.088 -176.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.9 m -63.3 -33.28 75.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.738 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -72.43 -37.27 68.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.556 -179.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -69.35 -54.73 13.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.853 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 24.8 m-85 -44.73 -69.11 0.15 Allowed 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.646 171.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.73 33.93 63.91 Favored Glycine 0 C--N 1.342 0.899 0 C-N-CA 120.961 -0.638 . . . . 0.0 114.05 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -67.46 -53.6 27.51 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 117.598 0.699 . . . . 0.0 109.537 179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.427 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.79 88.17 1.89 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.106 0.479 . . . . 0.0 111.09 176.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.0 ttm -69.97 -35.53 74.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 175.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.09 -36.55 84.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.548 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -89.47 -25.27 21.55 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.687 -0.805 . . . . 0.0 111.452 -172.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.427 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -68.83 -35.69 77.28 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 170.051 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.918 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -61.55 -46.81 88.35 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.922 175.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -69.79 -43.62 71.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.867 -176.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -70.58 -33.61 71.28 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -174.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.663 ' HB2' ' CD2' ' A' ' 25' ' ' LEU . 7.0 mt -86.97 -4.5 59.18 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.434 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.9 m 59.09 43.42 17.46 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.359 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.918 HD23 ' HA ' ' A' ' 20' ' ' LYS . 4.3 mm? -49.77 120.62 11.37 Favored Pre-proline 0 N--CA 1.468 0.469 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.9 174.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.652 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 12.3 Cg_exo -72.67 154.4 54.49 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 121.941 1.761 . . . . 0.0 110.814 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.704 ' HA ' HG22 ' A' ' 30' ' ' VAL . 15.0 p-10 -64.13 -27.36 69.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.826 -176.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.3 m -65.93 -36.26 82.87 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.122 0.487 . . . . 0.0 110.381 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.445 HG11 ' CB ' ' A' ' 47' ' ' LEU . 19.9 t -82.35 -41.04 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.476 -176.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 27' ' ' ASP . 27.4 m -58.87 -33.19 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 C-N-CA 120.269 -0.572 . . . . 0.0 109.838 175.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.98 -51.95 53.86 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.539 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.9 -37.2 86.52 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.061 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.7 tp -51.48 -51.74 52.47 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.847 -1.07 . . . . 0.0 111.63 174.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -67.84 11.56 0.14 Allowed 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.597 HD22 ' HB3' ' A' ' 39' ' ' ASP . 27.5 p-10 -59.67 111.11 1.31 Allowed 'General case' 0 C--N 1.346 0.429 0 CA-C-N 120.522 1.51 . . . . 0.0 111.382 -174.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -95.46 -2.66 48.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.925 0.393 . . . . 0.0 111.249 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.3 p90 -91.14 160.51 15.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.139 177.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.879 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.0 OUTLIER -73.26 80.23 1.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 122.074 0.94 . . . . 0.0 110.619 176.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB3' HD22 ' A' ' 35' ' ' ASN . 4.7 p-10 -44.82 -53.33 7.58 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 2.9 p30 49.02 33.06 4.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.595 0.758 . . . . 0.0 111.147 -169.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -106.56 177.37 4.87 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.69 -176.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.4 t -101.71 136.11 35.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.898 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.405 ' HB3' ' HE2' ' A' ' 43' ' ' MET . 51.8 ttp -70.75 101.46 2.1 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.6 p -97.72 -40.82 8.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.257 -173.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 47' ' ' LEU . 8.5 t70 -86.44 120.17 27.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.355 0.598 . . . . 0.0 112.052 -173.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.804 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -44.21 -42.28 6.4 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 114.493 -1.23 . . . . 0.0 113.155 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.701 HD22 ' HG2' ' A' ' 46' ' ' ARG . 3.7 mm? -64.67 -19.47 65.75 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 122.262 -0.274 . . . . 0.0 111.45 -175.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.531 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -80.08 -59.79 2.58 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 -178.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.54 -47.46 2.95 Favored Glycine 0 CA--C 1.534 1.257 0 CA-C-N 115.097 -0.956 . . . . 0.0 114.467 166.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.42 ' HB3' HD13 ' A' ' 23' ' ' LEU . 30.0 m -63.41 -43.76 96.6 Favored 'General case' 0 C--N 1.342 0.265 0 CA-C-N 118.489 1.144 . . . . 0.0 111.22 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.52 -23.79 66.29 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.646 0.239 . . . . 0.0 111.646 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.531 HG12 ' O ' ' A' ' 48' ' ' ALA . 48.0 mm -63.86 -34.24 66.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.108 0.48 . . . . 0.0 110.594 178.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -140.1 63.18 1.48 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.187 0.518 . . . . 0.0 111.277 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.431 ' CB ' HD11 ' A' ' 23' ' ' LEU . 28.7 p -114.54 -38.65 3.97 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 177.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 6.3 tt -62.72 -55.63 24.91 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.551 -170.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.1 -13.69 58.48 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.079 0.466 . . . . 0.0 110.42 -173.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.509 HG23 HG11 ' A' ' 61' ' ' VAL . 36.7 m -82.97 -35.89 25.56 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.54 176.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.449 ' NZ ' ' HB3' ' A' ' 58' ' ' LYS . 9.0 mtpm? -81.53 -16.03 53.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.265 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 12.2 mt -65.62 -65.32 0.69 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 121.008 -0.277 . . . . 0.0 110.255 170.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -175.7 121.31 0.19 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.706 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.509 HG11 HG23 ' A' ' 57' ' ' THR . 11.5 p -177.28 36.82 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.477 1.132 . . . . 0.0 109.12 -178.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.593 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.2 m -103.88 117.52 49.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.42 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -70.98 -54.41 7.54 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.956 177.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.7 Cg_endo -96.41 -145.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.844 0 C-N-CA 122.911 2.407 . . . . 0.0 112.906 -173.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.468 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 5.1 m-20 -76.71 10.14 2.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.376 -176.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 135.72 -69.56 0.52 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.167 -0.773 . . . . 0.0 111.167 -178.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.683 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.3 p-10 -69.12 149.42 48.69 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.712 -0.744 . . . . 0.0 111.36 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.618 HD23 HD22 ' A' ' 67' ' ' ASN . 4.0 mm? 69.7 31.69 3.5 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.593 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 16.5 p-80 -74.74 68.86 1.74 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.314 0.578 . . . . 0.0 110.878 172.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -86.39 -49.02 7.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.926 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.15 -53.7 43.54 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.17 -0.538 . . . . 0.0 112.582 -174.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -62.01 -27.67 69.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.75 -36.64 73.22 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.301 0.572 . . . . 0.0 110.672 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -80.03 -35.65 36.95 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.925 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.74 -37.58 88.08 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.402 173.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -63.07 -35.96 81.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.172 178.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.23 -37.05 74.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 176.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 81.0 mtp -74.44 -39.01 62.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.358 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -82.98 -12.34 57.38 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.804 0.335 . . . . 0.0 110.292 -177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -144.4 94.56 2.58 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.342 -178.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 120.83 -64.94 0.47 Allowed Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.046 -1.073 . . . . 0.0 113.428 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -105.23 138.34 41.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.032 0.444 . . . . 0.0 111.833 -175.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.612 ' OD2' HG22 ' A' ' 85' ' ' THR . 1.0 OUTLIER -84.05 174.46 10.27 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 172.246 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.485 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 30.1 mt-10 -62.22 -35.38 78.72 Favored 'General case' 0 N--CA 1.417 -2.082 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.47 -167.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.798 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 12.7 t -61.76 -38.37 87.75 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.12 -0.632 . . . . 0.0 110.751 -177.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 65.4 mtm -81.32 -39.38 25.24 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -174.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.486 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -60.58 -39.74 89.17 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.279 173.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -73.73 -26.4 60.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.709 -177.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.798 ' HG2' ' O ' ' A' ' 85' ' ' THR . 58.7 mm-40 -78.46 -23.56 46.45 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.619 177.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.642 ' O ' HG13 ' A' ' 94' ' ' ILE . 3.4 mm? -85.26 -49.04 8.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.961 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.531 HG22 ' HA ' ' A' ' 88' ' ' GLN . 19.9 m -57.99 -39.39 71.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -172.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -70.14 -43.06 71.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.869 0.366 . . . . 0.0 110.536 -176.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.762 HG23 ' SG ' ' A' ' 97' ' ' CYS . 3.2 mm -63.43 -42.12 95.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.335 177.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.686 ' O ' ' HB2' ' A' ' 98' ' ' GLU . 58.8 mt -51.55 -47.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.622 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 15.1 m170 -70.87 -36.46 72.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.166 0.508 . . . . 0.0 110.639 -175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.55 -49.5 4.6 Favored Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.334 -172.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.773 ' HB2' HG12 ' A' ' 114' ' ' VAL . 57.9 m -71.39 -35.76 71.16 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-O 119.029 -0.51 . . . . 0.0 110.867 -177.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.686 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 1.3 mt-10 -63.92 -37.73 88.48 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 118.603 0.638 . . . . 0.0 110.88 172.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -64.22 -35.87 82.21 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 121.041 0.448 . . . . 0.0 110.546 178.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.5 m -107.43 25.51 11.36 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -87.32 149.64 47.41 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.66 -175.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -59.16 149.24 81.6 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.364 2.043 . . . . 0.0 110.288 170.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -66.45 71.87 0.42 Allowed 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.857 2.372 . . . . 0.0 113.146 -177.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -99.73 91.66 4.96 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -81.2 77.27 8.11 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.962 -177.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.723 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.7 t70 -145.3 128.43 16.64 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.733 174.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.514 ' HE2' ' HB3' ' A' ' 107' ' ' LYS . 13.4 ttpt -29.25 -55.87 0.14 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 125.024 1.453 . . . . 0.0 114.508 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.444 ' CB ' ' HB2' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -93.72 -16.97 23.69 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -177.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.723 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 90.3 mmm -74.3 -32.14 62.76 Favored 'General case' 0 C--N 1.332 -0.193 0 O-C-N 121.841 -0.537 . . . . 0.0 111.731 -172.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.723 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -62.71 -49.53 74.71 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.692 0.758 . . . . 0.0 109.853 178.013 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.723 ' H ' ' HG2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.06 -14.21 6.22 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.367 -1.288 . . . . 0.0 112.468 175.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.501 ' O ' ' HG2' ' A' ' 116' ' ' MET . 0.5 OUTLIER -89.27 -39.71 12.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.513 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 12.2 t70 -62.94 -35.38 79.94 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.484 177.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.773 HG12 ' HB2' ' A' ' 97' ' ' CYS . 15.8 m -79.42 -38.15 19.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.025 0.441 . . . . 0.0 110.168 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.44 -49.1 78.92 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-O 121.544 0.688 . . . . 0.0 111.304 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.512 ' HA ' ' HD3' ' A' ' 119' ' ' LYS . 25.0 ptt? -69.58 -19.85 63.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 119.76 -0.776 . . . . 0.0 110.06 178.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.863 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 8.5 t -72.79 -24.17 60.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.482 ' HE1' ' HB3' ' A' ' 89' ' ' GLN . 57.6 t80 -77.76 -40.58 40.41 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.424 179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.512 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.2 pttp -67.82 -29.62 68.82 Favored 'General case' 0 C--O 1.223 -0.292 0 C-N-CA 118.725 -1.19 . . . . 0.0 110.348 176.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.863 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.99 -54.62 44.89 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.625 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.45 ' HG3' HD11 ' A' ' 93' ' ' ILE . 14.4 mm-40 -58.71 -52.03 67.44 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.844 176.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -54.91 -36.63 38.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 111.787 0.291 . . . . 0.0 111.787 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -70.86 -32.15 69.07 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.486 -0.486 . . . . 0.0 111.302 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -71.18 -33.94 70.46 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.214 0.53 . . . . 0.0 110.393 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 90.2 mt -66.23 -33.79 76.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.546 173.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 125' ' ' LEU . 53.4 m-80 75.92 123.44 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.583 0.753 . . . . 0.0 111.912 177.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 26.0 m95 50.04 -158.15 0.08 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.061 177.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.601 HG22 ' H ' ' A' ' 130' ' ' ASN . 7.6 p -131.46 129.14 22.13 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.087 -175.187 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 2.8 Cg_exo -76.69 15.81 1.02 Allowed 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 123.545 2.83 . . . . 0.0 112.968 -179.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.601 ' H ' HG22 ' A' ' 128' ' ' VAL . 22.2 t-20 -115.99 125.9 53.12 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.239 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 44.8 mtm -98.36 102.58 14.37 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.323 178.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -102.77 105.35 15.76 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.144 0.497 . . . . 0.0 110.285 175.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 46.8 tp -65.22 -30.02 70.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.404 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 134' ' ' VAL . 2.7 m -65.92 117.35 6.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.45 176.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.415 ' H ' HD12 ' A' ' 135' ' ' ILE . 0.5 OUTLIER -117.51 115.94 50.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.229 -178.616 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -55.57 133.63 49.64 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.67 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -66.11 139.79 58.18 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -178.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 8.4 p -137.58 141.25 39.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 120.878 0.371 . . . . 0.0 110.83 -176.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.563 HD22 ' H ' ' A' ' 141' ' ' GLU . 0.5 OUTLIER -118.31 129.08 55.24 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 177.85 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -83.46 -14.47 52.43 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.563 ' H ' HD22 ' A' ' 139' ' ' LEU . 46.3 mt-10 -105.23 149.82 25.64 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.875 0.369 . . . . 0.0 110.967 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 10.4 m . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.625 -0.702 . . . . 0.0 110.281 179.203 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 N--CA 1.474 0.748 0 CA-C-O 120.828 0.347 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.427 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 98.5 Cg_endo -83.73 -0.94 9.91 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.742 2.294 . . . . 0.0 112.515 178.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.7 mp0 -51.1 -70.57 0.08 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.784 -178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.68 HD13 ' HB2' ' A' ' 82' ' ' ALA . 5.5 tp -78.98 -9.48 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 121.149 0.499 . . . . 0.0 111.183 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 26.0 ttt -71.48 -30.09 65.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.33 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.684 ' HE3' ' HA ' ' A' ' 6' ' ' LYS . 1.8 tpmt? -89.28 103.84 16.44 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.768 176.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.586 ' HB2' ' HB3' ' A' ' 10' ' ' ASN . 6.3 m120 -84.85 127.57 34.21 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.771 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.3 mp -60.13 -52.99 63.0 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -176.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.6 m -64.57 -26.83 68.58 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.447 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.586 ' HB3' ' HB2' ' A' ' 7' ' ' ASN . 27.9 t-20 -75.62 -34.31 60.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.494 177.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -74.5 -55.4 5.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.943 177.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -50.08 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 174.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.94 45.28 81.5 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 120.669 -0.777 . . . . 0.0 113.051 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.53 -60.24 3.95 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.829 0.347 . . . . 0.0 110.988 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -150.5 93.76 2.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.54 179.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 26.3 ttp -74.07 -31.01 62.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.68 -30.42 63.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.252 -177.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -88.06 -26.21 22.66 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.037 -175.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 82.8 m -75.71 -31.04 59.49 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 170.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 1.029 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 23.4 tptp -56.18 -50.11 72.12 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.327 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -70.97 -39.49 72.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.775 -178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -69.74 -37.29 76.43 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -173.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.888 ' HB2' HD12 ' A' ' 25' ' ' LEU . 16.0 mt -86.22 -6.28 59.01 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.132 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.7 t 59.53 43.82 15.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.435 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.029 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 10.3 mp -50.14 124.87 18.14 Favored Pre-proline 0 N--CA 1.47 0.559 0 CA-C-N 115.496 -0.775 . . . . 0.0 112.313 179.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.582 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 11.1 Cg_exo -71.86 151.26 56.73 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.256 1.971 . . . . 0.0 110.072 170.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 30' ' ' VAL . 1.5 p30 -66.29 -26.01 67.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.847 0.356 . . . . 0.0 111.218 -176.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 p -65.76 -32.91 74.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.07 0.462 . . . . 0.0 110.7 176.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.492 HG11 ' HB2' ' A' ' 47' ' ' LEU . 23.8 t -79.04 -42.88 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.37 -177.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.537 HG22 ' HA ' ' A' ' 27' ' ' ASP . 34.8 m -59.61 -29.22 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.126 0.489 . . . . 0.0 109.745 175.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.65 -52.71 41.86 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.6 176.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.97 -36.31 81.91 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.323 0.583 . . . . 0.0 109.747 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.8 tp -47.09 -55.67 7.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.753 -1.112 . . . . 0.0 111.253 173.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -66.58 10.07 0.14 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -65.78 116.18 6.7 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 120.393 1.451 . . . . 0.0 109.895 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 93.9 m-85 -78.26 -28.79 47.8 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.289 -176.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 5.4 m95 -82.66 98.08 8.85 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 -174.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.9 mttp -91.35 67.5 5.72 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.984 -174.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -63.47 13.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.4 t70 58.06 70.47 0.65 Allowed 'General case' 0 C--N 1.345 0.403 0 CA-C-N 119.087 0.858 . . . . 0.0 110.096 -169.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -103.05 171.07 7.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.574 -176.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.8 t -90.67 113.56 26.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.133 0.492 . . . . 0.0 110.211 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.553 ' O ' HG21 ' A' ' 112' ' ' ILE . 40.4 ttm -79.25 95.5 5.67 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.809 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.1 p -93.22 -18.0 23.03 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -171.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -84.88 133.81 34.3 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 121.811 0.815 . . . . 0.0 110.517 178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HE ' ' CG ' ' A' ' 106' ' ' ASP . 9.9 mpt_? -68.98 -31.49 70.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.084 -1.416 . . . . 0.0 109.769 -173.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.582 ' HG ' ' HD3' ' A' ' 26' ' ' PRO . 4.4 mm? -75.11 -14.88 60.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.211 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -85.04 -58.29 2.75 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 -179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.453 ' O ' HG22 ' A' ' 52' ' ' ILE . . . -38.64 -45.01 1.91 Allowed Glycine 0 CA--C 1.534 1.261 0 CA-C-N 114.919 -1.037 . . . . 0.0 114.655 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.446 ' HB3' HD13 ' A' ' 23' ' ' LEU . 4.1 m -76.24 -44.92 35.27 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.473 1.136 . . . . 0.0 112.247 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -69.4 -23.87 63.78 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 49' ' ' GLY . 14.7 tt -71.72 -19.86 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.901 0.382 . . . . 0.0 110.945 -177.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -144.08 85.24 1.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.076 0.465 . . . . 0.0 110.229 179.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 23.9 t -121.76 -45.24 2.29 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.55 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.433 ' H ' HD22 ' A' ' 55' ' ' LEU . 3.2 mm? -58.25 -49.07 78.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.97 0.414 . . . . 0.0 111.51 -174.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.53 -15.67 51.48 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.962 0.41 . . . . 0.0 110.921 -174.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 61' ' ' VAL . 0.2 OUTLIER -83.78 -34.63 24.72 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.396 177.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.46 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 43.2 mtpt -82.92 -12.92 56.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.199 175.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.27 -64.09 0.95 Allowed 'General case' 0 N--CA 1.441 -0.879 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.888 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -175.05 111.7 0.13 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.467 HG12 ' O ' ' A' ' 57' ' ' THR . 8.1 p -176.0 32.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-O 121.327 0.584 . . . . 0.0 111.497 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.583 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 28.8 m -109.65 117.58 54.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 O-C-N 121.28 -0.888 . . . . 0.0 111.659 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB2' ' HA ' ' A' ' 69' ' ' HIS . 0.1 OUTLIER -65.73 -59.68 8.75 Favored Pre-proline 0 CA--C 1.535 0.372 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 177.485 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.714 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 27.6 Cg_endo -104.87 -139.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.109 0 C-N-CA 123.52 2.813 . . . . 0.0 112.607 -171.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.472 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -72.13 -0.3 11.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.153 -177.652 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 147.78 -75.7 0.27 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.995 -177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.714 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 1.7 p-10 -70.06 152.68 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.084 -0.558 . . . . 0.0 111.637 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.528 HD23 HD22 ' A' ' 67' ' ' ASN . 4.6 mm? 70.98 27.67 3.34 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.504 0.722 . . . . 0.0 112.325 174.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ASP . 4.4 p80 -74.65 68.12 1.62 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 111.119 171.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -87.49 -31.66 19.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.395 -178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -67.6 -63.33 3.77 Favored Glycine 0 C--N 1.333 0.392 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.953 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.598 ' HA ' ' HB3' ' A' ' 75' ' ' ASP . 7.9 m-80 -55.26 -25.43 33.66 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 122.913 0.485 . . . . 0.0 112.087 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.27 -38.09 75.01 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.38 0.61 . . . . 0.0 110.291 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.511 ' HE3' HD13 ' A' ' 94' ' ' ILE . 59.9 mmtt -81.5 -36.43 29.26 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.762 177.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.598 ' HB3' ' HA ' ' A' ' 72' ' ' ASN . 11.2 t70 -60.58 -40.67 92.58 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.361 174.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -60.83 -42.41 97.69 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.443 175.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.39 -30.25 68.19 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.434 -178.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.473 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 84.7 mtp -74.23 -40.88 62.12 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.614 ' HG3' ' CD2' ' A' ' 80' ' ' HIS . 13.6 ptpt -94.28 -7.89 40.65 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.456 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.771 ' HB3' HD21 ' A' ' 8' ' ' LEU . 42.5 m-70 -139.91 90.82 2.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.36 176.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.38 -75.74 0.42 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.646 173.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.68 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -96.91 149.8 21.46 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.511 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.2 OUTLIER -84.37 169.4 14.65 Favored 'General case' 0 CA--C 1.497 -1.086 0 N-CA-C 108.512 -0.922 . . . . 0.0 108.512 173.092 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -67.05 -38.22 85.46 Favored 'General case' 0 N--CA 1.411 -2.405 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.148 -168.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.761 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.7 OUTLIER -62.21 -33.51 74.69 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.08 -179.029 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 7.4 tpt -84.56 -39.98 18.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 -176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.493 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -57.98 -38.97 77.05 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.535 172.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.553 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -71.67 -23.83 61.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.197 -178.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.761 ' HG2' ' O ' ' A' ' 85' ' ' THR . 9.0 mm-40 -77.21 -25.75 52.05 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.1 tp -86.95 -44.91 11.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.274 -175.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.553 HG22 ' HA ' ' A' ' 88' ' ' GLN . 26.7 m -57.36 -34.46 46.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.281 -175.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.69 -44.07 78.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.42 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 118' ' ' PHE . 1.6 mp -65.46 -41.06 90.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.854 175.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.511 HD13 ' HE3' ' A' ' 74' ' ' LYS . 86.4 mt -55.45 -48.24 77.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.681 -177.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -72.28 -35.26 68.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.897 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.9 -43.71 7.52 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.125 -1.036 . . . . 0.0 111.879 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.666 ' SG ' HG23 ' A' ' 93' ' ' ILE . 63.0 m -72.79 -34.54 66.98 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 121.398 -0.121 . . . . 0.0 110.789 179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -57.41 -38.38 74.24 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 120.819 0.343 . . . . 0.0 110.732 170.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -64.77 -43.23 93.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.168 175.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.1 m -99.0 25.17 6.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.841 0.353 . . . . 0.0 111.745 -176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 102' ' ' PRO . . . -76.09 148.21 81.04 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.606 178.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 23.9 Cg_exo -64.42 151.38 85.73 Favored 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.672 2.248 . . . . 0.0 111.871 179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.4 Cg_exo -70.55 59.3 2.01 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.369 2.713 . . . . 0.0 112.824 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -121.61 116.72 25.13 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 174.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -81.12 93.17 6.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.919 0.39 . . . . 0.0 111.249 -176.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.732 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 6.2 m-20 -130.03 97.65 4.53 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.318 0.58 . . . . 0.0 110.152 170.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.523 ' HE3' ' HB3' ' A' ' 107' ' ' LYS . 0.0 OUTLIER -42.65 -49.05 5.58 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 176.321 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.06 -24.14 28.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.871 1.214 . . . . 0.0 112.16 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.732 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 2.4 mmm -85.54 -26.72 26.02 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -169.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.48 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.1 OUTLIER -56.78 -45.95 81.8 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 121.737 0.779 . . . . 0.0 111.311 -170.46 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.56 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -57.93 -14.06 5.62 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.288 177.363 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.553 HG21 ' O ' ' A' ' 43' ' ' MET . 3.7 mp -90.13 -37.14 9.21 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 176.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -60.09 -35.31 74.93 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.518 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 111' ' ' THR . 16.5 m -81.26 -34.97 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.15 -47.79 84.44 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-O 121.243 0.544 . . . . 0.0 111.653 174.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.573 ' HA ' ' CE ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -68.99 -20.18 64.16 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.194 -0.602 . . . . 0.0 110.523 179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.516 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 43.2 t -73.02 -23.12 60.57 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.863 173.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.744 ' HB2' HG21 ' A' ' 93' ' ' ILE . 34.8 t80 -79.76 -46.56 16.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.403 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.573 ' CE ' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.17 -25.21 64.24 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 118.499 -1.28 . . . . 0.0 109.345 177.6 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.561 ' HE3' ' O ' ' A' ' 116' ' ' MET . 3.5 ttmt -54.02 -55.69 24.93 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.166 169.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 27.4 mm-40 -59.11 -40.52 85.62 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.509 173.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.544 HD13 HD12 ' A' ' 125' ' ' LEU . 0.4 OUTLIER -57.23 -35.23 47.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 CA-C-N 118.467 0.576 . . . . 0.0 111.349 176.949 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 -72.46 -31.67 65.61 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.115 0.484 . . . . 0.0 111.135 173.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -71.0 -22.35 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.556 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.544 HD12 HD13 ' A' ' 122' ' ' ILE . 96.6 mt -71.05 5.48 2.04 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.727 176.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 10.5 p30 46.82 -160.28 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.337 1.055 . . . . 0.0 112.57 -178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.6 m95 -75.25 -60.73 2.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.929 -174.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER 67.62 145.53 0.1 Allowed Pre-proline 0 CA--C 1.537 0.452 0 O-C-N 123.94 0.775 . . . . 0.0 110.971 -176.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -63.6 100.36 0.28 Allowed 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.231 1.954 . . . . 0.0 111.246 175.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 23.6 p30 -90.77 170.41 10.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.377 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 25.2 ptm -93.38 150.21 20.64 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.084 -176.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -83.92 162.02 20.63 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 175.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 27.7 tp -129.15 46.27 2.66 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.395 0.617 . . . . 0.0 110.076 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.46 112.27 18.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.548 179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 1.9 mp -80.22 133.14 30.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.063 178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -69.82 89.02 0.3 Allowed Glycine 0 N--CA 1.451 -0.342 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 174.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.03 140.78 55.38 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 122.617 0.367 . . . . 0.0 111.75 -173.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 10.4 p -54.54 139.7 12.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.831 -178.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 10.5 tt -101.27 -26.89 13.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.47 178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -63.48 124.83 22.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.035 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -130.71 -70.53 0.61 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.791 174.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.355 -0.831 . . . . 0.0 109.901 178.719 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.471 0.594 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.483 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 32.3 Cg_exo -58.18 -21.75 53.16 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.044 2.496 . . . . 0.0 112.518 -178.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -49.25 -68.25 0.19 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.823 177.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.8 tp -78.15 -14.3 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.115 0.483 . . . . 0.0 111.447 -177.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.483 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.7 mmm -80.15 -21.43 43.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.197 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.5 tttp -90.56 114.11 26.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -88.99 135.04 33.76 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.457 -179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.868 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.7 mp -58.03 -48.15 80.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.173 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.5 m -60.83 -37.02 80.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.004 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -70.54 -37.22 74.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.841 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -72.09 -56.75 5.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.406 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -58.7 -79.94 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 177.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 53.95 42.08 69.49 Favored Glycine 0 C--N 1.344 0.99 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.726 -171.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -81.9 -36.98 27.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.211 0.529 . . . . 0.0 110.528 -176.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.06 55.74 1.38 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.574 0.702 . . . . 0.0 109.638 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.445 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 53.9 tpp -69.77 -37.71 76.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.135 -0.939 . . . . 0.0 109.709 -177.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -54.09 -38.07 64.94 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.594 178.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 30.2 mt-30 -90.67 -27.24 19.14 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.346 -0.542 . . . . 0.0 111.67 -171.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 54' ' ' CYS . 9.1 p -76.83 -33.04 57.95 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 174.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.777 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 8.9 tptp -57.91 -49.69 75.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.75 172.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.91 -39.94 72.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.393 -178.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 3.2 tm-20 -68.57 -39.27 81.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.201 -175.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.3 mt -77.37 -4.71 46.59 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.122 0.487 . . . . 0.0 110.385 179.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 44.2 m 65.43 36.3 6.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.504 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.777 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 18.2 mt -65.07 120.09 64.18 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.786 179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.581 ' CD ' HD21 ' A' ' 47' ' ' LEU . 7.9 Cg_exo -73.95 163.41 36.96 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.838 2.359 . . . . 0.0 110.444 171.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -62.34 -32.32 73.07 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.408 -174.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.4 m -63.95 -52.9 57.59 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.803 0.335 . . . . 0.0 111.447 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.662 HG21 HD23 ' A' ' 47' ' ' LEU . 59.1 t -70.14 -53.38 23.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.75 -175.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.455 HG22 ' CE2' ' A' ' 34' ' ' TYR . 9.9 p -59.9 -30.01 44.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 120.909 -0.316 . . . . 0.0 111.007 -176.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.84 -51.48 40.04 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 177.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -64.05 -34.58 78.35 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.661 0.743 . . . . 0.0 109.388 178.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 30' ' ' VAL . 0.3 OUTLIER -53.82 -38.73 64.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.612 171.214 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.455 ' CE2' HG22 ' A' ' 30' ' ' VAL . 19.6 m-85 -76.28 9.13 2.76 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -65.4 108.01 1.83 Allowed 'General case' 0 C--O 1.232 0.139 0 CA-C-N 118.915 0.78 . . . . 0.0 109.89 178.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -71.27 -33.57 69.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.732 -175.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 25.9 m-90 -74.13 126.84 31.44 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.468 0.652 . . . . 0.0 110.294 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.814 ' HD3' ' H ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -75.99 69.9 2.64 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.808 -178.711 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.636 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 29.1 t70 -43.62 -23.96 0.1 Allowed 'General case' 0 CA--C 1.551 0.986 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 176.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 36.1 t0 67.32 71.4 0.36 Allowed 'General case' 0 C--N 1.351 0.637 0 CA-C-N 118.97 0.804 . . . . 0.0 109.553 -177.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.636 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.2 p90 -124.19 169.84 11.33 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.758 -177.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.4 t -90.21 132.77 34.0 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 172.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 35.9 ttp -68.95 93.19 0.55 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.477 0.656 . . . . 0.0 109.621 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 35.9 p -88.33 -40.65 13.42 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.737 -173.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.585 ' OD2' ' HB3' ' A' ' 47' ' ' LEU . 24.1 t70 -80.96 117.74 21.84 Favored 'General case' 0 CA--C 1.505 -0.751 0 CA-C-O 122.246 1.022 . . . . 0.0 111.059 178.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.724 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.33 -37.39 62.27 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 113.066 -1.879 . . . . 0.0 111.792 172.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.662 HD23 HG21 ' A' ' 29' ' ' VAL . 28.3 tp -71.27 -18.06 62.44 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-O 120.989 0.423 . . . . 0.0 110.95 -173.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.42 ' O ' HG13 ' A' ' 52' ' ' ILE . . . -80.82 -51.87 8.13 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 177.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.95 -46.03 1.7 Allowed Glycine 0 CA--C 1.531 1.073 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.212 165.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 31.9 m -68.87 -43.42 75.39 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 118.393 1.097 . . . . 0.0 109.596 -179.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.58 -9.47 58.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.57 -0.741 . . . . 0.0 112.354 -176.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 48' ' ' ALA . 55.9 mt -59.22 -36.17 61.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.05 0.452 . . . . 0.0 110.282 175.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 44.5 t-20 -135.47 84.77 2.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.59 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.3 p -102.26 -45.51 5.1 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.9 -178.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 59' ' ' LEU . 61.9 tp -60.64 -57.02 14.5 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.267 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.22 -15.69 54.91 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.009 0.433 . . . . 0.0 110.762 -170.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.605 HG23 HG11 ' A' ' 61' ' ' VAL . 96.0 m -74.79 -34.0 62.35 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.556 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 14.8 mmmt -79.36 -25.85 42.16 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.435 177.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.1 mm? -65.42 -64.29 0.9 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.846 172.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -176.27 117.17 0.13 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.691 0.282 . . . . 0.0 110.776 -175.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG23 ' A' ' 57' ' ' THR . 11.2 p -166.43 32.33 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.239 1.019 . . . . 0.0 109.338 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.715 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 35.5 m -111.28 120.68 62.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.176 -174.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.19 -56.15 2.04 Favored Pre-proline 0 CA--C 1.533 0.318 0 O-C-N 122.277 -0.264 . . . . 0.0 111.43 175.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.683 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 10.9 Cg_endo -97.04 -146.69 0.02 OUTLIER 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 123.155 2.57 . . . . 0.0 112.682 -173.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.411 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.8 OUTLIER -74.56 11.76 0.94 Allowed 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -175.788 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 132.77 -68.88 0.54 Allowed Glycine 0 C--N 1.317 -0.49 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.316 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.815 HD22 HD23 ' A' ' 68' ' ' LEU . 3.6 p-10 -70.0 149.5 47.65 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.43 177.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.815 HD23 HD22 ' A' ' 67' ' ' ASN . 4.0 mm? 68.69 31.73 4.45 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 173.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.715 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 13.3 p80 -73.9 72.6 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.583 0.706 . . . . 0.0 111.669 176.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -87.34 -47.52 8.74 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.044 -179.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.63 -59.07 11.51 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 116.057 -0.52 . . . . 0.0 112.89 -173.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -63.28 -24.18 67.75 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.29 -36.51 68.98 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.221 0.534 . . . . 0.0 110.378 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HZ1' ' HB1' ' A' ' 87' ' ' ALA . 3.1 mmmp? -79.91 -33.37 39.9 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.891 178.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.653 ' O ' ' HG2' ' A' ' 79' ' ' LYS . 20.9 t70 -64.23 -42.1 96.71 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.084 174.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -63.89 -39.52 94.37 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.82 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.7 -33.7 72.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.164 -178.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 68.7 mtm -74.06 -31.88 63.04 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.961 -178.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.653 ' HG2' ' O ' ' A' ' 75' ' ' ASP . 3.7 ptpp? -93.16 -14.16 27.53 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.867 -0.733 . . . . 0.0 111.583 177.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.868 ' HB3' HD21 ' A' ' 8' ' ' LEU . 47.5 m-70 -139.08 92.64 2.61 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.403 178.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 130.27 -75.02 0.43 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.579 174.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.22 146.22 30.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.579 0.228 . . . . 0.0 110.559 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.686 ' OD1' HG22 ' A' ' 85' ' ' THR . 2.5 p30 -87.54 174.71 8.31 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 121.343 0.592 . . . . 0.0 110.643 173.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -49.46 69.95 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.334 -1.303 . . . . 0.0 112.56 -166.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.76 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.1 t -62.76 -32.27 73.39 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.465 -175.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 72.0 mtp -79.59 -39.46 31.65 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.447 0.641 . . . . 0.0 109.53 -173.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.507 ' HB1' ' HZ1' ' A' ' 74' ' ' LYS . . . -63.14 -31.64 72.84 Favored 'General case' 0 N--CA 1.443 -0.802 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.507 176.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.822 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -82.35 -19.61 38.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.8 -179.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.76 ' HG2' ' O ' ' A' ' 85' ' ' THR . 75.4 mm-40 -78.58 -23.68 45.89 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 171.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 94' ' ' ILE . 24.9 tp -85.98 -43.86 12.82 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.006 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.822 HG22 ' HA ' ' A' ' 88' ' ' GLN . 2.8 m -57.67 -29.73 35.36 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 -175.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -68.08 -43.02 79.51 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.265 0.555 . . . . 0.0 109.865 -178.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.625 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.01 -42.05 85.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.058 175.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.645 HG13 ' O ' ' A' ' 90' ' ' LEU . 27.2 mt -54.95 -47.59 76.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 CA-C-O 120.921 0.391 . . . . 0.0 110.174 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.5 m170 -70.22 -37.07 74.95 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.826 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.94 -48.39 5.2 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.277 -173.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.807 ' HB2' HG12 ' A' ' 114' ' ' VAL . 39.7 m -72.98 -37.42 67.05 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -67.36 -37.36 83.09 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 117.969 0.349 . . . . 0.0 110.494 175.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.34 -33.4 75.77 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 120.814 0.34 . . . . 0.0 110.577 176.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.7 m -97.73 8.11 45.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.324 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -78.24 155.51 79.44 Favored Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.885 -177.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.512 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 59.6 Cg_exo -52.88 138.21 60.85 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.75 2.3 . . . . 0.0 111.977 176.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 14.7 Cg_exo -71.28 35.1 0.27 Allowed 'Trans proline' 0 CA--C 1.533 0.462 0 C-N-CA 123.592 2.861 . . . . 0.0 113.208 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -95.94 119.47 34.49 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -76.97 96.03 4.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.94 0.4 . . . . 0.0 111.435 -175.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.943 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 11.5 t70 -144.38 119.03 9.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.346 169.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.0 ttmp? -29.92 -71.83 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.074 1.484 . . . . 0.0 113.776 178.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.42 ' O ' HD13 ' A' ' 112' ' ' ILE . 81.6 m -88.79 -14.72 36.39 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 -174.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.943 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -63.12 -42.62 99.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 118.703 0.683 . . . . 0.0 110.453 -178.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.668 ' HG3' ' H ' ' A' ' 111' ' ' THR . 0.6 OUTLIER -64.44 -49.97 69.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.651 0.738 . . . . 0.0 110.422 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.668 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -59.04 -13.4 6.6 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.009 -0.996 . . . . 0.0 112.913 175.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.531 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -88.3 -35.86 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.625 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.2 OUTLIER -59.81 -37.56 79.5 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.046 173.254 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.807 HG12 ' HB2' ' A' ' 97' ' ' CYS . 16.7 m -78.02 -38.29 24.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.733 178.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.07 -52.59 64.71 Favored 'General case' 0 C--O 1.243 0.734 0 CA-C-O 121.006 0.432 . . . . 0.0 111.739 -178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.648 ' SD ' ' HE2' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.4 -24.68 63.88 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.58 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.92 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 13.8 t -69.09 -25.43 64.42 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.594 0.712 . . . . 0.0 110.142 176.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.609 ' HA ' HG12 ' A' ' 93' ' ' ILE . 75.1 t80 -79.81 -43.09 23.05 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.133 -176.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 2.6 pttp -68.12 -28.1 67.04 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.411 -0.916 . . . . 0.0 109.736 177.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.92 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -57.42 -54.95 41.01 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.709 0.29 . . . . 0.0 111.008 173.211 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.542 ' HG3' ' N ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -59.52 -47.59 84.94 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 -179.346 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.542 ' N ' ' HG3' ' A' ' 121' ' ' GLU . 1.9 tt -59.85 -31.24 46.97 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 120.932 0.396 . . . . 0.0 110.943 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -70.6 -30.86 67.65 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 176.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -36.15 69.2 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.0 mt -69.54 -38.49 77.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.407 174.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 65.3 t30 52.24 -110.09 0.49 Allowed 'General case' 0 CA--C 1.531 0.22 0 O-C-N 123.51 0.506 . . . . 0.0 109.731 -179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -138.16 135.13 35.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 169.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.7 t 62.62 83.09 0.21 Allowed Pre-proline 0 CA--C 1.535 0.377 0 CA-C-O 121.223 0.535 . . . . 0.0 110.708 -177.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -88.43 119.89 1.19 Allowed 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.835 2.356 . . . . 0.0 111.764 179.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -94.96 106.41 18.39 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.168 0.508 . . . . 0.0 110.951 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 61.1 mtt -81.73 141.08 33.89 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.316 176.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -85.16 127.14 34.15 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 120.936 -0.306 . . . . 0.0 110.424 -176.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 58.8 tp -83.01 83.22 7.91 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.26 0.552 . . . . 0.0 109.971 177.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 47.6 t -81.51 137.78 20.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.538 177.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -143.49 98.91 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.362 0.601 . . . . 0.0 110.874 -178.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -87.31 160.67 32.07 Favored Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.663 -0.779 . . . . 0.0 111.355 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -106.89 151.1 25.7 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.9 m -116.33 105.0 17.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 121.462 0.648 . . . . 0.0 111.218 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.77 ' H ' HD23 ' A' ' 139' ' ' LEU . 0.6 OUTLIER -86.42 102.2 13.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.032 178.002 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -90.22 112.19 23.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.623 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -80.16 116.35 20.21 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.097 177.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 30.8 m . . . . . 0 C--O 1.249 1.062 0 CA-C-O 117.876 -1.059 . . . . 0.0 112.542 -178.296 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.424 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 66.8 m . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 120.581 0.229 . . . . 0.0 110.801 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 1' ' ' SER . 24.9 Cg_endo -63.34 -21.36 71.59 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.416 2.077 . . . . 0.0 111.738 177.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.437 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 15.7 mp0 -49.93 -69.56 0.11 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.934 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.3 tp -78.19 -12.94 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.05 0.453 . . . . 0.0 111.495 -176.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 74.5 mmm -79.5 -21.83 44.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 110.958 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -89.11 103.84 16.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.967 -179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -62.44 136.17 57.78 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.916 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.683 ' H ' HD23 ' A' ' 8' ' ' LEU . 1.5 pt? -56.4 -42.96 78.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.843 178.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.763 ' HB3' HD13 ' A' ' 55' ' ' LEU . 50.8 m -61.44 -30.28 70.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -74.7 -31.66 61.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.083 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -75.6 -49.36 18.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.145 176.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -46.7 -74.2 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 172.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 56.3 46.04 87.35 Favored Glycine 0 C--N 1.34 0.751 0 C-N-CA 120.381 -0.914 . . . . 0.0 112.661 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.604 ' H ' HD23 ' A' ' 55' ' ' LEU . 87.9 tttt -67.76 -62.03 1.6 Allowed 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 117.057 0.429 . . . . 0.0 110.987 -179.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.87 102.83 3.31 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.551 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.4 mmt -70.65 -25.29 62.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.17 0.51 . . . . 0.0 110.168 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.45 -31.11 70.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.777 -178.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -88.87 -25.63 22.05 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.389 -0.524 . . . . 0.0 110.85 -170.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 99.7 m -74.25 -34.58 63.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.189 0.519 . . . . 0.0 109.764 173.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -62.2 -47.29 85.12 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.893 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -76.14 -48.15 21.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.678 -176.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -67.82 -32.3 72.75 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -174.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.583 ' CB ' HD13 ' A' ' 25' ' ' LEU . 4.1 mm? -88.9 -17.42 29.62 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.667 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.4 m 60.61 36.25 19.77 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -170.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.71 HD23 HG12 ' A' ' 30' ' ' VAL . 2.0 tp -57.08 121.81 49.06 Favored Pre-proline 0 N--CA 1.456 -0.138 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.801 -172.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 25' ' ' LEU . 17.9 Cg_exo -68.54 155.67 68.22 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.694 2.263 . . . . 0.0 110.804 173.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.697 ' HA ' HG22 ' A' ' 30' ' ' VAL . 52.7 p30 -70.9 -20.53 62.49 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.587 -175.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 2.9 m -66.38 -37.52 85.47 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 109.876 173.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.408 HG21 ' HD2' ' A' ' 26' ' ' PRO . 61.7 t -73.58 -51.43 25.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.885 -177.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.71 HG12 HD23 ' A' ' 25' ' ' LEU . 35.5 m -57.42 -36.31 52.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-O 120.937 0.399 . . . . 0.0 110.931 178.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.62 -51.71 57.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.731 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.14 -25.25 60.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.144 0.497 . . . . 0.0 110.167 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 15.6 tp -56.59 -52.75 63.62 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.406 174.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -74.57 10.04 1.52 Allowed 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 178.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -65.36 126.21 27.52 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.852 0.751 . . . . 0.0 111.184 -175.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -82.87 -35.05 26.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.349 -177.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -72.73 134.25 44.92 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.191 0.519 . . . . 0.0 111.005 -174.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 55.5 pttt -77.54 67.76 3.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.217 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -43.69 -54.71 4.87 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 171.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.0 t70 64.63 70.35 0.49 Allowed 'General case' 0 C--N 1.347 0.472 0 CA-C-O 121.699 0.762 . . . . 0.0 109.919 -177.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -125.59 178.66 5.53 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.164 -0.926 . . . . 0.0 110.158 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 62.0 t -83.69 128.88 38.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 176.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 51.0 ttm -68.03 92.44 0.38 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.253 0.549 . . . . 0.0 109.669 177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 57.1 p -92.12 -32.63 15.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.493 -174.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.44 ' OD2' ' HB2' ' A' ' 47' ' ' LEU . 13.7 t70 -70.87 129.84 40.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.401 0.62 . . . . 0.0 111.227 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.402 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 1.6 mpt_? -75.2 -20.88 59.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.296 -175.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.566 ' HB3' ' CD1' ' A' ' 25' ' ' LEU . 3.4 mm? -78.34 -15.73 58.42 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.109 -177.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.454 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.0 -62.49 1.65 Allowed 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 -177.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.714 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -41.3 -48.12 4.55 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-N 114.845 -1.071 . . . . 0.0 114.475 169.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.3 m -66.97 -42.63 84.81 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.541 1.171 . . . . 0.0 111.794 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.01 -18.83 65.6 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.397 0.518 . . . . 0.0 112.397 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.454 HG12 ' O ' ' A' ' 48' ' ' ALA . 46.3 mm -54.67 -40.25 50.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.277 175.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -118.6 77.15 1.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.024 177.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 8.7 t -125.28 -46.72 1.77 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.048 -0.523 . . . . 0.0 112.278 -177.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 9' ' ' SER . 7.5 mp -66.77 -74.95 0.1 Allowed 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.413 0.625 . . . . 0.0 111.743 -170.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.14 -3.22 54.41 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.326 0.584 . . . . 0.0 110.069 -176.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.527 ' HA ' HG11 ' A' ' 61' ' ' VAL . 81.1 m -83.63 -35.99 24.2 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.354 173.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.432 ' HE2' ' HB3' ' A' ' 58' ' ' LYS . 2.1 mtpt -77.49 -15.52 59.25 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.056 172.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 14.1 tp -64.94 -66.41 0.55 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.529 172.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 61' ' ' VAL . 22.2 t70 -176.22 121.26 0.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.5 p -179.47 43.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.622 0.725 . . . . 0.0 111.655 -176.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.576 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 3.3 m -105.97 121.46 58.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 O-C-N 121.046 -1.034 . . . . 0.0 110.366 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.666 ' HA ' HD22 ' A' ' 72' ' ' ASN . 1.8 t70 -64.55 -55.21 31.17 Favored Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.794 178.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.693 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 9.5 Cg_endo -97.72 -138.85 0.01 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 123.233 2.622 . . . . 0.0 113.298 -172.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.438 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 22.4 t70 -71.28 -5.51 32.79 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.226 -173.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 140.27 -56.75 0.61 Allowed Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -170.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 3.6 p-10 -84.32 149.47 26.03 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.085 -0.557 . . . . 0.0 111.029 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 68.46 46.43 1.03 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.34 0.591 . . . . 0.0 110.799 169.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -75.14 81.42 2.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.534 0.683 . . . . 0.0 111.32 178.678 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -86.0 -63.25 1.35 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.232 -175.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -60.32 -60.27 8.88 Favored Glycine 0 CA--C 1.507 -0.442 0 C-N-CA 121.278 -0.487 . . . . 0.0 113.05 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.666 HD22 ' HA ' ' A' ' 63' ' ' ASP . 13.9 m-20 -55.49 -29.04 58.06 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.453 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.29 -37.18 66.32 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.056 0.455 . . . . 0.0 110.919 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 78' ' ' MET . 72.6 mmtt -79.33 -33.67 42.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -64.04 -39.98 95.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.379 174.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.507 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 42.4 t80 -63.65 -32.51 74.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.396 177.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.71 -32.94 71.8 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.651 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.55 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 55.0 mtt -69.39 -28.12 65.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.859 177.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' A' ' 76' ' ' PHE . 49.3 mtmt -86.31 -15.65 39.95 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.065 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -145.58 96.0 2.75 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.664 0.269 . . . . 0.0 111.199 -176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 121.08 -62.99 0.51 Allowed Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.396 -0.906 . . . . 0.0 112.48 173.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.574 ' HB1' ' HB2' ' A' ' 86' ' ' MET . . . -104.08 139.48 39.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.746 0.308 . . . . 0.0 111.032 -177.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.634 ' OD1' HG22 ' A' ' 85' ' ' THR . 0.9 OUTLIER -88.11 175.97 7.49 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.408 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -54.47 -38.36 66.3 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.747 -171.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.634 HG22 ' OD1' ' A' ' 83' ' ' ASP . 8.3 t -73.69 -25.09 60.07 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.497 -178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.753 ' HA ' HE21 ' A' ' 89' ' ' GLN . 54.0 mtt -84.62 -39.61 18.46 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.51 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -65.38 -39.26 92.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.352 175.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.452 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -76.61 -25.37 53.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.422 -174.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.753 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.1 pt20 -83.1 -23.43 33.06 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.334 -0.547 . . . . 0.0 110.071 173.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.1 tt -82.97 -48.17 10.96 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.698 0.285 . . . . 0.0 110.481 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 87' ' ' ALA . 16.6 m -57.33 -36.19 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.883 -176.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -65.77 -41.3 92.23 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.009 0.433 . . . . 0.0 110.568 -176.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.547 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.4 mp -62.46 -42.59 96.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.694 176.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 90' ' ' LEU . 34.2 mt -56.97 -48.13 82.16 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.152 -178.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.3 m170 -67.0 -34.69 78.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.208 0.528 . . . . 0.0 110.233 -176.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -48.81 5.57 Favored Glycine 0 N--CA 1.438 -1.184 0 C-N-CA 120.171 -1.014 . . . . 0.0 111.705 -172.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 11.7 m -74.82 -31.45 61.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-O 118.734 -0.651 . . . . 0.0 112.669 178.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.586 ' CG ' HG11 ' A' ' 114' ' ' VAL . 37.5 mt-10 -57.36 -37.15 72.16 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 119.328 0.967 . . . . 0.0 109.833 166.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -72.79 -43.53 62.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.925 0.342 . . . . 0.0 111.925 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.8 m -97.68 15.51 23.31 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -81.06 154.38 72.51 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.467 0.175 . . . . 0.0 110.573 177.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.42 ' HB2' ' OD1' ' A' ' 104' ' ' ASN . 13.8 Cg_exo -69.45 163.12 39.23 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.831 2.354 . . . . 0.0 110.939 176.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -69.44 40.72 0.29 Allowed 'Trans proline' 0 CA--C 1.534 0.515 0 C-N-CA 123.17 2.58 . . . . 0.0 113.379 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.42 ' OD1' ' HB2' ' A' ' 102' ' ' PRO . 2.6 m-20 -83.07 93.69 7.65 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -81.57 94.48 6.91 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.984 0.421 . . . . 0.0 110.825 -176.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.823 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 10.1 t70 -133.14 107.36 8.15 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -28.79 -58.74 0.13 Allowed 'General case' 0 N--CA 1.473 0.693 0 O-C-N 124.967 1.417 . . . . 0.0 114.59 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.22 -15.99 22.83 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -176.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.823 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 12.9 ttt -85.18 -25.49 27.36 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -167.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' H ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -59.17 -47.08 86.61 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-O 122.292 1.044 . . . . 0.0 110.741 -177.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.709 HG22 HD12 ' A' ' 112' ' ' ILE . 0.3 OUTLIER -53.94 -14.33 0.99 Allowed 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.522 -1.217 . . . . 0.0 112.29 174.308 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.714 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.6 mp -91.95 -41.68 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -177.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 110' ' ' LYS . 1.0 OUTLIER -62.78 -32.43 73.59 Favored 'General case' 0 CA--C 1.519 -0.24 0 C-N-CA 120.266 -0.574 . . . . 0.0 110.735 176.644 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 3.5 m -80.39 -35.21 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.113 0 CA-C-O 121.211 0.529 . . . . 0.0 110.143 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.56 -48.75 78.09 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.812 0.815 . . . . 0.0 111.557 174.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.715 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -68.57 -19.34 64.47 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.845 179.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.595 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 6.6 t -69.48 -30.32 68.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.105 173.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.537 ' HA ' HG12 ' A' ' 93' ' ' ILE . 62.9 t80 -70.99 -43.38 68.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.844 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.582 ' HD3' ' HA ' ' A' ' 116' ' ' MET . 0.9 OUTLIER -69.35 -29.63 67.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 118.95 -1.1 . . . . 0.0 110.501 176.322 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.715 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -56.1 -47.88 77.22 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.413 0.625 . . . . 0.0 109.97 168.091 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.529 ' HG2' HD11 ' A' ' 93' ' ' ILE . 9.4 tp10 -57.09 -50.0 74.15 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.595 176.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.4 OUTLIER -56.63 -31.26 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 CA-C-O 120.629 0.252 . . . . 0.0 111.211 177.763 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 7.8 m-70 -71.74 -32.09 67.37 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.66 ' O ' ' HD3' ' A' ' 124' ' ' LYS . 9.8 tmtt? -72.15 -27.9 62.9 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 92.8 mt -73.83 12.84 0.6 Allowed 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.135 -0.938 . . . . 0.0 111.976 179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -40.76 120.74 1.34 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.39 0.676 . . . . 0.0 112.115 -177.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -80.05 28.85 0.28 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.487 -0.779 . . . . 0.0 112.395 -174.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.475 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 11.6 m -67.05 124.44 88.83 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-O 120.751 0.31 . . . . 0.0 110.969 179.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 17.5 Cg_exo -66.95 -56.96 0.21 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.769 2.312 . . . . 0.0 112.161 179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 51.4 t30 68.17 -72.19 0.1 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.835 0.709 . . . . 0.0 111.394 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 26.0 mmt -105.9 171.94 7.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.75 0.31 . . . . 0.0 110.476 -178.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -103.62 -177.05 3.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.346 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.7 mp 52.99 67.42 1.0 Allowed 'General case' 0 N--CA 1.464 0.266 0 O-C-N 123.741 0.651 . . . . 0.0 110.775 -179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.7 p -80.55 95.93 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.48 0.657 . . . . 0.0 110.888 -175.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 28.9 mm 61.45 83.53 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.028 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -126.39 87.47 0.35 Allowed Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.238 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -127.72 103.41 7.28 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.6 p -127.92 126.37 66.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.177 0.513 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 57.9 tp -89.51 -67.24 0.85 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.379 179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . 68.98 130.39 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.044 0.84 . . . . 0.0 111.961 -178.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.569 ' HG3' HG12 ' A' ' 142' ' ' VAL . 12.2 pt-20 -80.34 -29.1 37.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.47 178.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.569 HG12 ' HG3' ' A' ' 141' ' ' GLU . 7.6 p . . . . . 0 C--O 1.249 1.028 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.8 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 120.585 0.231 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 130' ' ' ASN . 19.3 Cg_exo -66.89 -19.54 52.36 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.855 2.37 . . . . 0.0 112.176 179.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -46.48 -66.12 0.45 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.305 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.533 HD13 ' HB2' ' A' ' 82' ' ' ALA . 8.3 tp -81.3 -10.33 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.915 0.388 . . . . 0.0 111.56 -176.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 85.7 mmm -75.35 -23.69 57.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.127 0.489 . . . . 0.0 110.037 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -91.12 114.92 27.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.273 172.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -62.35 138.79 58.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.964 -177.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 38.1 mt -55.18 -40.06 70.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.691 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.8 p -64.62 -34.85 79.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.144 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -71.58 -33.78 69.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.334 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -67.65 -53.87 24.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.549 177.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -46.67 -71.91 0.06 Allowed 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.935 169.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.43 37.44 60.23 Favored Glycine 0 C--N 1.345 1.033 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.683 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -80.78 -49.72 10.77 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.152 0.501 . . . . 0.0 110.061 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' ' 18' ' ' GLN . . . -160.12 106.14 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.419 177.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 61.3 mtm -76.83 -21.15 55.47 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 175.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.447 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 32.0 t70 -58.8 -27.63 65.23 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.276 -1.329 . . . . 0.0 112.092 178.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 15' ' ' ALA . 20.7 pt20 -84.07 -24.74 30.26 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.116 0.484 . . . . 0.0 109.884 -177.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 63.5 m -73.45 -29.89 62.85 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 172.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 55.7 tptt -62.67 -53.42 54.72 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.721 177.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -69.69 -43.77 71.79 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.041 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -69.51 -41.18 76.4 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.293 -174.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.529 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 7.1 mt -82.07 -16.58 49.59 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.613 -177.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 47.0 m 57.79 43.31 22.06 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -172.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.596 HD23 HD12 ' A' ' 47' ' ' LEU . 50.1 mt -57.65 129.71 81.25 Favored Pre-proline 0 N--CA 1.468 0.433 0 CA-C-N 114.669 -1.151 . . . . 0.0 110.262 -175.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 20.6 Cg_exo -65.88 155.83 67.34 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 121.95 1.767 . . . . 0.0 110.449 173.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -57.85 -34.82 70.13 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.069 0.462 . . . . 0.0 111.032 -176.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 m -70.18 -42.1 72.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.382 -0.827 . . . . 0.0 111.235 -176.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.566 HG11 ' HB2' ' A' ' 47' ' ' LEU . 21.4 t -72.62 -53.85 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.63 -173.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.684 ' HA ' ' CD2' ' A' ' 33' ' ' LEU . 1.9 p -59.64 -30.64 45.24 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.177 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.87 -52.46 56.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.75 175.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.25 -38.1 68.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -176.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.684 ' CD2' ' HA ' ' A' ' 30' ' ' VAL . 2.4 pp -61.43 -32.56 72.53 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.584 -0.447 . . . . 0.0 110.742 178.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 8.6 m-30 -64.67 8.18 0.13 Allowed 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 174.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -67.05 111.99 4.15 Favored 'General case' 0 C--N 1.342 0.242 0 CA-C-N 120.272 1.396 . . . . 0.0 111.011 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -84.31 -4.36 58.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.05 0.452 . . . . 0.0 110.56 178.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.6 m-90 -90.03 145.29 25.19 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 176.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -83.31 58.53 4.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.437 0.637 . . . . 0.0 110.636 -178.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.524 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 5.5 t70 -42.6 -40.68 2.78 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.524 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 40.9 m-20 78.62 25.41 0.54 Allowed 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 118.783 0.72 . . . . 0.0 111.155 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.43 175.82 9.94 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.957 0.408 . . . . 0.0 110.957 178.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.32 124.56 52.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 45.9 ttm -78.84 92.74 4.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.049 0.452 . . . . 0.0 110.484 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.3 p -95.22 -30.91 13.75 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.71 -178.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -70.39 135.14 48.52 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-O 122.005 0.907 . . . . 0.0 110.827 -177.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.851 ' HG3' ' HB2' ' A' ' 109' ' ' MET . 1.5 mpt_? -73.69 -30.94 63.18 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.845 -1.525 . . . . 0.0 109.919 -170.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.596 HD12 HD23 ' A' ' 25' ' ' LEU . 4.1 mm? -73.64 -15.63 61.25 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.032 -177.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.88 -59.22 2.49 Favored 'General case' 0 CA--C 1.51 -0.594 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -176.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.941 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -38.82 -47.07 2.35 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 115.361 -0.836 . . . . 0.0 114.057 166.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 7.7 m -66.5 -41.07 89.46 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.452 1.126 . . . . 0.0 111.752 177.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.9 -18.06 65.2 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -177.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.2 mm -56.78 -37.34 52.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.921 0.391 . . . . 0.0 110.671 176.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.422 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 60.3 t30 -141.08 86.59 2.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.248 0.547 . . . . 0.0 110.307 178.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 2.7 p -106.82 -46.85 3.86 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.473 -178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 9.6 tt -68.2 -44.98 74.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.086 -174.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' A' ' 59' ' ' LEU . . . -81.26 -13.32 58.61 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.9 0.381 . . . . 0.0 110.246 -174.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.672 ' HA ' HG11 ' A' ' 61' ' ' VAL . 91.3 m -79.05 -34.56 43.68 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.297 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -75.93 -20.93 57.58 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.433 176.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' A' ' 56' ' ' ALA . 9.5 mt -65.42 -66.19 0.58 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.482 175.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -177.19 116.59 0.1 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.672 HG11 ' HA ' ' A' ' 57' ' ' THR . 7.0 p -173.31 32.89 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 CA-C-O 121.313 0.578 . . . . 0.0 111.52 -174.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.629 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 23.4 m -109.55 115.88 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 121.161 -0.962 . . . . 0.0 111.992 -175.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -74.51 -54.5 3.04 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.766 177.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.643 ' HD3' ' HA ' ' A' ' 69' ' ' HIS . 18.7 Cg_endo -99.15 -141.59 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 123.134 2.556 . . . . 0.0 113.246 -172.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.503 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 17.9 m-20 -75.45 10.1 1.84 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.668 -175.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 133.38 -75.32 0.42 Allowed Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.206 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.691 HD22 HD23 ' A' ' 68' ' ' LEU . 2.2 p-10 -70.35 152.86 43.66 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.962 -0.619 . . . . 0.0 110.8 177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.691 HD23 HD22 ' A' ' 67' ' ' ASN . 3.9 mm? 69.13 34.81 2.92 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.574 0.546 . . . . 0.0 112.106 173.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.643 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 6.4 p-80 -73.31 77.53 1.34 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.738 0.78 . . . . 0.0 110.514 174.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.9 t60 -86.41 -61.71 1.68 Allowed 'General case' 0 C--O 1.24 0.568 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.746 -174.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.16 -51.94 56.21 Favored Glycine 0 CA--C 1.51 -0.275 0 C-N-CA 121.256 -0.497 . . . . 0.0 112.444 -177.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -58.71 -28.53 65.9 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.837 -0.181 . . . . 0.0 111.44 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.566 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.23 -37.15 66.49 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.697 -0.627 . . . . 0.0 110.885 -177.097 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.9 mmmt -81.03 -31.42 34.57 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.259 -0.576 . . . . 0.0 110.111 178.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -64.73 -40.31 95.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.327 173.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.415 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 64.2 t80 -62.98 -32.35 73.67 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.143 176.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.89 -38.62 79.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.69 176.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.569 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 66.0 mtm -69.26 -27.69 65.65 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.315 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.947 ' HA ' ' HE3' ' A' ' 79' ' ' LYS . 0.2 OUTLIER -91.42 -12.44 34.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.46 179.266 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -141.33 90.98 2.35 Favored 'General case' 0 N--CA 1.457 -0.112 0 O-C-N 122.183 -0.323 . . . . 0.0 111.042 -177.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 109.55 -62.49 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.432 -0.89 . . . . 0.0 113.524 173.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.569 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -89.38 124.36 34.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.634 0.254 . . . . 0.0 110.912 -175.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.644 ' OD2' HG22 ' A' ' 85' ' ' THR . 4.6 p-10 -83.75 171.34 13.27 Favored 'General case' 0 CA--C 1.506 -0.724 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.551 174.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -48.54 72.61 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-N 115.194 -0.912 . . . . 0.0 112.393 -164.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.775 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 15.0 t -61.0 -36.74 80.28 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.054 -173.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 50.4 mtm -81.01 -38.96 26.64 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 121.409 0.623 . . . . 0.0 109.5 -173.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.43 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -59.55 -39.64 84.65 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.165 173.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.49 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.32 -25.92 61.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.368 -177.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.775 ' HG2' ' O ' ' A' ' 85' ' ' THR . 67.1 mm-40 -77.99 -25.58 48.14 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 175.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.533 ' O ' HG13 ' A' ' 94' ' ' ILE . 33.4 tp -88.13 -46.36 9.35 Favored 'General case' 0 N--CA 1.456 -0.153 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.494 -176.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.49 HG22 ' HA ' ' A' ' 88' ' ' GLN . 15.4 m -56.92 -36.61 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.108 -173.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -65.73 -42.37 91.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.901 0.381 . . . . 0.0 110.579 -176.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.576 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.6 mp -61.85 -38.88 81.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.041 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 47.1 mt -59.91 -45.79 94.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.209 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -68.51 -34.45 75.91 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 -176.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.29 -49.68 5.13 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.47 -0.872 . . . . 0.0 112.244 -173.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 101' ' ' ALA . 7.7 m -73.33 -31.23 63.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.563 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.765 ' HG3' HG11 ' A' ' 114' ' ' VAL . 18.8 mt-10 -65.29 -34.43 78.32 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.401 1.001 . . . . 0.0 110.271 169.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -64.81 -44.03 91.22 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.171 176.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.6 m -101.49 9.11 41.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -174.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -67.66 150.34 97.87 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.5 159.75 15.72 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 0.0 111.358 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -73.48 23.88 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.258 0 C-N-CA 122.535 2.157 . . . . 0.0 113.078 -176.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -94.71 91.92 6.75 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 175.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -81.48 95.98 7.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.558 0.694 . . . . 0.0 110.427 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.75 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.4 t70 -101.26 133.69 45.45 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.791 177.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -29.39 -72.32 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 O-C-N 125.327 1.642 . . . . 0.0 112.947 177.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.0 t -96.41 -21.79 17.55 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -176.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.851 ' HB2' ' HG3' ' A' ' 46' ' ' ARG . 59.1 ttp -77.39 -15.75 59.2 Favored 'General case' 0 N--CA 1.449 -0.475 0 O-C-N 121.883 -0.51 . . . . 0.0 112.237 -168.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.428 ' CG ' ' H ' ' A' ' 111' ' ' THR . 12.1 ptmm? -56.27 -51.76 66.99 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-O 122.431 1.11 . . . . 0.0 109.355 175.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.428 ' H ' ' CG ' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -60.18 -13.0 10.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.644 -1.616 . . . . 0.0 112.446 173.011 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.941 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -89.02 -40.58 13.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -177.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -62.29 -37.26 84.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.652 177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.765 HG11 ' HG3' ' A' ' 98' ' ' GLU . 12.1 m -77.61 -35.67 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.885 178.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.14 -49.27 76.55 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.17 0.51 . . . . 0.0 111.204 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.539 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 21.6 ptt? -69.79 -17.91 63.44 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.478 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.968 ' HA ' ' HE2' ' A' ' 120' ' ' LYS . 39.5 t -69.46 -32.78 71.91 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 122.143 0.973 . . . . 0.0 109.022 176.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -74.11 -38.11 63.93 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.93 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.589 ' HD2' ' C ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -67.66 -26.37 66.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 118.364 -1.334 . . . . 0.0 111.629 179.64 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.968 ' HE2' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -64.72 -56.36 14.19 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.539 -1.265 . . . . 0.0 109.354 172.05 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.0 -41.65 88.17 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.944 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -35.18 56.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-N 118.305 0.502 . . . . 0.0 110.697 176.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -72.06 -30.52 65.23 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 176.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -72.5 -33.71 67.14 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.121 0.486 . . . . 0.0 110.146 177.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.56 -35.49 80.35 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.412 171.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 69.29 -86.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.464 0.706 . . . . 0.0 112.391 176.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -76.5 124.25 27.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.201 0.524 . . . . 0.0 112.171 -173.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 13.2 m -124.12 155.22 68.1 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.526 174.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.446 ' O ' ' HB3' ' A' ' 130' ' ' ASN . 16.9 Cg_exo -68.18 93.01 0.4 Allowed 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.702 2.268 . . . . 0.0 113.069 -177.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.47 ' HB3' ' HD3' ' A' ' 2' ' ' PRO . 2.8 p-10 176.23 165.69 0.43 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.055 171.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.6 mmt -129.58 137.11 50.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.703 0.287 . . . . 0.0 110.658 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -87.34 95.45 10.0 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.216 -0.447 . . . . 0.0 109.971 179.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.908 HD13 ' H ' ' A' ' 133' ' ' LEU . 0.0 OUTLIER -99.67 8.74 44.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.402 -177.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 30.4 t -94.58 86.68 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.043 0.449 . . . . 0.0 110.305 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.1 mp -118.84 111.85 35.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -165.25 -57.91 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.344 -0.931 . . . . 0.0 111.885 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 53.24 84.21 0.06 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.445 0.64 . . . . 0.0 110.526 -178.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 6.0 m -63.98 115.55 2.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.942 -175.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 62.2 tp -113.94 105.75 13.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.188 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -107.99 -174.62 2.57 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.628 -174.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 66.47 28.83 9.41 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.926 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 C--O 1.25 1.09 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.202 176.581 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.9 m . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.907 0.384 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.435 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 82.1 Cg_endo -90.2 -0.67 5.47 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.924 2.416 . . . . 0.0 112.645 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -50.17 -70.61 0.08 Allowed 'General case' 0 N--CA 1.465 0.306 0 O-C-N 123.903 0.752 . . . . 0.0 112.376 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.456 HD12 ' HB2' ' A' ' 82' ' ' ALA . 14.5 tt -87.2 -10.75 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.61 177.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.435 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 51.1 ttp -62.65 -40.76 98.06 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.469 0.652 . . . . 0.0 109.53 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -92.18 100.59 13.18 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.568 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 10' ' ' ASN . 57.2 m-80 -61.54 124.77 21.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.309 -172.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 tt -63.12 -30.61 71.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.143 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.507 ' HA ' ' HD2' ' A' ' 12' ' ' PHE . 3.4 p -69.31 -35.34 75.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.577 175.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.424 ' HB2' ' HB2' ' A' ' 7' ' ' ASN . 0.2 OUTLIER -72.4 -26.59 61.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.278 177.275 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -67.55 -40.01 84.98 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.507 ' HD2' ' HA ' ' A' ' 9' ' ' SER . 33.0 m-85 -55.02 -85.43 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.341 168.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 48.64 36.08 17.73 Favored Glycine 0 C--N 1.346 1.085 0 C-N-CA 121.108 -0.568 . . . . 0.0 113.747 -178.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 14' ' ' LYS . 2.2 tmmm? -65.88 -39.14 90.4 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.026 0.441 . . . . 0.0 110.58 -177.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.01 96.91 2.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.131 0.491 . . . . 0.0 111.498 -177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -80.14 -32.71 38.93 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -56.59 -40.49 75.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.307 -1.315 . . . . 0.0 111.693 178.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -88.12 -24.78 23.29 Favored 'General case' 0 C--N 1.319 -0.738 0 C-N-CA 120.303 -0.559 . . . . 0.0 111.42 -169.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.2 t -73.37 -36.07 66.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 119.949 -0.7 . . . . 0.0 109.138 173.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 1.095 ' HA ' HD13 ' A' ' 25' ' ' LEU . 10.6 tptt -63.44 -39.29 94.09 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.643 0.735 . . . . 0.0 109.877 176.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -69.19 -40.92 77.76 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.269 -1.332 . . . . 0.0 111.651 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -71.46 -44.47 64.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -175.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.769 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 10.6 mt -86.35 -4.8 59.24 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.463 -175.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.3 t 63.3 34.26 13.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.509 176.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.095 HD13 ' HA ' ' A' ' 20' ' ' LYS . 6.4 mp -50.42 119.24 10.66 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.931 -176.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.513 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.0 Cg_exo -73.75 162.89 38.55 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.979 2.453 . . . . 0.0 111.655 174.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.624 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.4 p-10 -62.81 -29.67 70.9 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -174.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 25.4 t -68.18 -37.61 81.14 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.339 0.59 . . . . 0.0 110.03 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.926 HG21 HD23 ' A' ' 47' ' ' LEU . 41.5 t -75.45 -49.96 25.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.706 -177.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.624 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.6 m -55.91 -35.12 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 120.672 0.272 . . . . 0.0 110.749 177.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.16 -49.57 69.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.883 0.373 . . . . 0.0 111.632 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -68.43 -38.33 81.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.9 0.857 . . . . 0.0 109.17 179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 3.1 tm? -55.76 -55.67 29.61 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.863 -1.517 . . . . 0.0 110.996 175.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -67.9 12.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.954 0 N-CA-C 115.613 1.708 . . . . 0.0 115.613 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.84 HD21 ' HB2' ' A' ' 39' ' ' ASP . 33.8 t30 -56.19 110.96 0.84 Allowed 'General case' 0 C--N 1.35 0.6 0 CA-C-N 120.051 1.296 . . . . 0.0 110.547 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -78.71 -27.86 45.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.679 -172.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -88.3 157.77 18.65 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 -174.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.505 ' H ' ' HD2' ' A' ' 38' ' ' LYS . 7.1 mptt -82.83 61.24 5.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.764 -175.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.84 ' HB2' HD21 ' A' ' 35' ' ' ASN . 1.0 OUTLIER -43.79 -48.21 8.12 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.82 -1.082 . . . . 0.0 113.628 176.108 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 68.19 19.68 9.06 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 118.258 0.481 . . . . 0.0 111.016 -178.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.588 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -78.42 179.12 7.2 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.005 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 t -89.66 130.61 38.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.318 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 42.3 ttm -65.29 104.47 0.95 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.089 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.0 p -87.25 -40.62 14.36 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -173.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.514 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 6.2 t70 -90.64 117.48 29.33 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-O 122.284 1.04 . . . . 0.0 110.718 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.58 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.02 -38.45 62.38 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 113.161 -1.836 . . . . 0.0 112.242 175.551 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.926 HD23 HG21 ' A' ' 29' ' ' VAL . 46.5 tp -68.82 -18.18 64.13 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-O 120.939 0.399 . . . . 0.0 111.05 -174.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -76.7 -55.99 5.01 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 174.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.72 -45.37 1.48 Allowed Glycine 0 CA--C 1.533 1.159 0 CA-C-N 114.727 -1.124 . . . . 0.0 114.41 165.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 57.5 m -65.54 -43.41 90.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 118.09 0.945 . . . . 0.0 110.319 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -68.39 -25.45 65.06 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.776 -176.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 64.4 mt -77.24 -26.66 15.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.286 0.565 . . . . 0.0 110.33 177.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.76 44.36 1.5 Allowed 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.05 -45.18 2.57 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.5 -170.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.633 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 3.2 mm? -46.46 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -171.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -82.19 -15.49 53.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.811 0.338 . . . . 0.0 110.899 -172.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.421 HG23 HG11 ' A' ' 61' ' ' VAL . 1.5 m -78.62 -32.06 47.26 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.746 -179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.612 ' NZ ' ' HB3' ' A' ' 58' ' ' LYS . 0.3 OUTLIER -82.52 -23.43 34.61 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.099 -0.24 . . . . 0.0 110.779 174.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 10.6 mt -63.38 -59.95 4.01 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 121.179 -0.209 . . . . 0.0 111.249 176.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -174.01 122.53 0.31 Allowed 'General case' 0 C--O 1.233 0.207 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -176.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.434 HG22 ' HB3' ' A' ' 72' ' ' ASN . 9.8 p -177.11 33.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-O 121.59 0.71 . . . . 0.0 111.142 -179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.651 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 35.5 m -98.3 114.07 34.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 O-C-N 121.25 -0.907 . . . . 0.0 110.579 -176.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.21 -56.75 4.1 Favored Pre-proline 0 CA--C 1.53 0.198 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.237 -176.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.585 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 4.4 Cg_endo -91.81 -144.78 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.815 2.343 . . . . 0.0 112.715 -172.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 0.6 OUTLIER -74.64 10.5 1.34 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.371 -176.393 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 143.01 -75.55 0.31 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.572 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.691 HD22 HD23 ' A' ' 68' ' ' LEU . 1.2 p-10 -75.06 168.61 19.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.051 -0.575 . . . . 0.0 111.075 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.691 HD23 HD22 ' A' ' 67' ' ' ASN . 3.6 mm? 70.12 28.62 3.99 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 123.76 0.663 . . . . 0.0 111.952 173.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 7.9 p80 -76.83 65.9 2.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.402 0.62 . . . . 0.0 110.832 172.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -88.9 -49.75 6.61 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.138 176.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.11 -51.86 54.84 Favored Glycine 0 C--N 1.334 0.465 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.502 -176.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.434 ' HB3' HG22 ' A' ' 61' ' ' VAL . 1.6 t-20 -59.24 -35.65 74.05 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.72 -0.24 . . . . 0.0 111.512 -176.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.86 -37.07 70.28 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 121.1 0.476 . . . . 0.0 111.068 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.606 ' O ' ' HG3' ' A' ' 78' ' ' MET . 5.2 mmmp? -80.64 -36.14 32.97 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.077 -0.649 . . . . 0.0 110.828 -178.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.489 ' HA ' ' HE2' ' A' ' 78' ' ' MET . 26.0 t70 -65.58 -41.04 93.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.924 0.392 . . . . 0.0 110.433 175.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -60.63 -37.8 82.69 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.088 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.79 71.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.298 178.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.606 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.1 mtm -74.36 -34.96 63.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.797 0.332 . . . . 0.0 111.803 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 56.5 tttt -93.88 -8.42 40.34 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 119.953 -0.699 . . . . 0.0 110.93 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -141.89 88.53 2.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.72 179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 129.17 -74.79 0.43 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.424 -0.893 . . . . 0.0 112.621 177.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.532 ' O ' ' HA ' ' A' ' 78' ' ' MET . . . -107.66 141.13 39.64 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.08 165.63 23.77 Favored 'General case' 0 CA--C 1.489 -1.388 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 11.2 pt-20 -67.49 -21.39 65.51 Favored 'General case' 0 N--CA 1.409 -2.484 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.628 -164.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.71 -28.2 63.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.643 -179.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.697 ' HA ' HE21 ' A' ' 89' ' ' GLN . 38.8 mtt -83.74 -39.76 19.69 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.578 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.59 -37.74 87.51 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.718 178.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.552 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -77.71 -27.01 50.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.8 -174.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.697 HE21 ' HA ' ' A' ' 86' ' ' MET . 28.9 pt20 -79.96 -24.19 41.15 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.209 172.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.492 ' O ' HG13 ' A' ' 94' ' ' ILE . 25.6 tp -81.41 -46.15 15.04 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.13 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 87' ' ' ALA . 17.7 m -57.57 -33.32 44.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.959 -175.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -64.77 -45.16 87.52 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.326 -178.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.66 -40.0 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 91' ' ' VAL . 74.2 mt -54.43 -50.05 60.6 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.275 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -71.76 -33.41 68.61 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.645 -174.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -81.1 -49.55 5.53 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.684 -174.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 114' ' ' VAL . 0.1 OUTLIER -72.63 -28.59 62.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.796 179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.51 ' HB2' HG11 ' A' ' 114' ' ' VAL . 35.9 tt0 -62.33 -38.62 90.15 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 120.672 0.273 . . . . 0.0 111.405 170.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -67.43 -33.69 75.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 120.893 0.378 . . . . 0.0 110.481 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.5 m -96.38 8.76 43.2 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.279 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.61 155.59 87.22 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.705 -178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.515 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 92.2 Cg_exo -45.08 140.59 7.25 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.159 2.573 . . . . 0.0 112.425 176.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.8 Cg_exo -69.59 24.81 0.17 Allowed 'Trans proline' 0 N--CA 1.476 0.469 0 C-N-CA 123.695 2.93 . . . . 0.0 113.703 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' A' ' 102' ' ' PRO . 89.3 m-20 -109.04 93.95 4.78 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 172.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -76.46 95.13 3.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.396 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.654 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 9.7 t70 -121.2 124.42 44.64 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.275 172.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.581 ' HD2' ' H ' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -33.81 -51.31 0.39 Allowed 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 114.255 1.206 . . . . 0.0 114.255 -178.346 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.581 ' H ' ' HD2' ' A' ' 107' ' ' LYS . 91.4 m -92.4 -30.71 15.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.654 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 62.6 mmm -61.67 -46.08 91.27 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 122.1 0.953 . . . . 0.0 110.162 -176.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.68 ' O ' HG13 ' A' ' 114' ' ' VAL . 15.8 ptmt -66.09 -50.56 63.65 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.524 -1.217 . . . . 0.0 110.485 -178.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.521 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -58.66 -15.33 11.28 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.106 -0.952 . . . . 0.0 113.27 -178.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 108' ' ' CYS . 1.5 mp -89.16 -39.67 12.59 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.534 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -38.97 87.44 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.188 174.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.68 HG13 ' O ' ' A' ' 110' ' ' LYS . 2.8 m -80.13 -39.33 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-O 121.497 0.665 . . . . 0.0 110.11 -173.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.78 -41.39 99.23 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.03 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.659 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -67.33 -24.52 65.74 Favored 'General case' 0 N--CA 1.443 -0.817 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.49 -177.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 114' ' ' VAL . 86.6 m -66.63 -30.74 71.08 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-O 121.183 0.516 . . . . 0.0 109.943 174.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -70.07 -40.64 74.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.246 177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.512 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.5 OUTLIER -68.49 -20.4 64.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.898 177.366 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.659 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -64.84 -49.26 71.29 Favored 'General case' 0 C--N 1.342 0.28 0 O-C-N 121.815 -0.553 . . . . 0.0 109.559 168.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 10.1 mm-40 -58.7 -50.84 72.38 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.165 176.139 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.512 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -54.12 -36.12 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 117.629 0.195 . . . . 0.0 111.24 178.725 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.9 m170 -70.55 -32.65 70.16 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -68.87 -35.6 77.1 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.097 0.475 . . . . 0.0 110.079 175.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 72.1 mt -68.06 -36.35 79.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.6 174.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.22 -54.55 29.68 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.981 0.512 . . . . 0.0 112.111 -178.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -57.78 107.17 0.43 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.724 -0.217 . . . . 0.0 110.796 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 15.3 m 38.53 83.1 0.21 Allowed Pre-proline 0 N--CA 1.471 0.576 0 O-C-N 124.359 1.037 . . . . 0.0 113.262 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -80.99 156.62 20.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.642 2.228 . . . . 0.0 111.918 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -63.49 130.96 46.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.159 177.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 22.3 ttt -77.61 108.47 10.83 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.025 -176.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -150.06 106.99 3.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.84 174.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 133' ' ' LEU . 3.7 mm? -94.62 90.21 6.05 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.331 -176.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 3.3 p -94.05 93.36 3.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.777 0.799 . . . . 0.0 110.82 178.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 4.5 mp -112.17 104.13 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.785 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -94.02 58.47 2.09 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.774 -0.727 . . . . 0.0 111.426 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -131.84 134.22 45.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.945 0.402 . . . . 0.0 111.225 -174.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 7.8 p -156.2 133.03 2.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.293 174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 49.7 tp -106.04 98.83 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.82 0.343 . . . . 0.0 110.695 -175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -142.14 105.64 4.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.701 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -123.24 118.92 28.7 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.544 178.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 44.4 t . . . . . 0 C--O 1.249 1.06 0 CA-C-O 117.952 -1.023 . . . . 0.0 109.962 -175.33 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.621 ' H2 ' ' HD2' ' A' ' 2' ' ' PRO . 18.3 m . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.863 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 19.0 Cg_endo -58.21 -14.37 19.4 Favored 'Trans proline' 0 C--N 1.363 1.319 0 C-N-CA 122.783 2.322 . . . . 0.0 113.95 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.482 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 4.3 mp0 -45.03 -67.56 0.27 Allowed 'General case' 0 N--CA 1.467 0.382 0 O-C-N 123.389 0.43 . . . . 0.0 111.281 179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.718 HD13 ' HB2' ' A' ' 82' ' ' ALA . 9.3 tp -87.68 -11.04 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.84 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.863 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 84.9 mtp -72.9 -21.44 60.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.957 0.408 . . . . 0.0 110.947 -178.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -86.7 81.14 8.32 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 171.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.628 HD21 HG13 ' A' ' 52' ' ' ILE . 3.8 m-20 -61.75 130.39 45.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.886 -176.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.488 HD23 HD22 ' A' ' 11' ' ' ASN . 84.7 mt -58.3 -33.78 69.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.51 -178.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.4 t -62.03 -39.41 92.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.981 0.419 . . . . 0.0 109.956 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -76.13 -31.16 58.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.787 178.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.488 HD22 HD23 ' A' ' 8' ' ' LEU . 87.0 m-20 -67.92 -49.55 61.23 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -48.26 -74.2 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.942 170.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 52.66 35.59 46.32 Favored Glycine 0 C--N 1.344 0.981 0 C-N-CA 120.736 -0.745 . . . . 0.0 113.477 -178.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -73.95 -37.51 64.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 121.053 0.454 . . . . 0.0 110.319 -178.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.476 ' H ' HD11 ' A' ' 55' ' ' LEU . . . -144.52 104.36 4.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.525 179.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 53.2 ttm -81.16 -32.29 33.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.241 0.544 . . . . 0.0 109.569 179.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -57.8 -33.0 68.1 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.7 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -88.1 -25.01 23.23 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.076 -0.65 . . . . 0.0 111.362 -173.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -71.45 -34.95 70.71 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 173.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -63.68 -48.1 78.55 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.374 0.607 . . . . 0.0 110.205 176.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -70.4 -47.6 60.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.465 -177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' HG2' ' HD2' ' A' ' 58' ' ' LYS . 2.8 tp10 -69.51 -35.14 75.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.451 0.167 . . . . 0.0 111.349 -173.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.662 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 3.9 mm? -77.31 -22.19 52.32 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 120.939 0.4 . . . . 0.0 110.423 176.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 51.1 m 58.55 41.52 22.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.975 -1.011 . . . . 0.0 108.53 -169.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.662 ' HG ' ' CB ' ' A' ' 23' ' ' LEU . 55.9 mt -65.68 139.43 97.03 Favored Pre-proline 0 CA--C 1.516 -0.342 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.861 -172.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.577 ' HG2' HG23 ' A' ' 29' ' ' VAL . 75.1 Cg_endo -82.24 163.64 17.37 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.734 2.289 . . . . 0.0 110.259 170.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.82 -33.44 75.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.757 0.313 . . . . 0.0 111.17 -175.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 17.2 p -67.89 -47.36 69.06 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.109 -178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.577 HG23 ' HG2' ' A' ' 26' ' ' PRO . 65.1 t -73.43 -46.94 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 CA-C-N 115.769 -0.651 . . . . 0.0 112.377 -173.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.51 -32.2 50.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 CA-C-N 118.743 0.701 . . . . 0.0 110.634 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -68.44 -52.01 37.45 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.806 177.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -66.84 -33.92 76.67 Favored 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.6 tp -49.43 -53.98 19.95 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.931 170.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.0 m-85 -65.58 11.89 0.06 Allowed 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 116.448 2.018 . . . . 0.0 116.448 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -63.75 98.91 0.21 Allowed 'General case' 0 C--N 1.345 0.407 0 CA-C-N 120.813 1.642 . . . . 0.0 109.789 176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -73.5 -20.83 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.129 -174.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 47.5 p90 -76.76 147.41 37.31 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 178.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -76.08 67.52 2.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.4 0.619 . . . . 0.0 110.863 179.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.653 ' OD1' ' HB3' ' A' ' 41' ' ' TYR . 3.1 t70 -43.44 -52.23 6.14 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.601 177.039 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.776 ' HB3' ' H ' ' A' ' 131' ' ' MET . 26.9 t70 73.19 20.41 3.34 Favored 'General case' 0 C--N 1.355 0.842 0 CA-C-O 122.243 1.021 . . . . 0.0 109.583 -177.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.653 ' HB3' ' OD1' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -85.17 177.97 7.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.359 178.151 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 48.8 t -89.84 126.69 42.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.942 177.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.8 ttm -71.66 103.43 3.04 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.28 -40.95 17.37 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.18 -172.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.485 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.0 t70 -89.06 116.63 27.47 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-O 121.771 0.796 . . . . 0.0 110.316 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.734 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -54.12 -37.13 64.01 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.901 -1.499 . . . . 0.0 112.257 176.239 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.576 HD21 ' HD3' ' A' ' 26' ' ' PRO . 27.9 tp -66.54 -15.25 63.26 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-O 121.286 0.565 . . . . 0.0 110.813 -174.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.31 -51.6 8.7 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.807 ' HA3' HD11 ' A' ' 112' ' ' ILE . . . -40.34 -45.76 3.34 Favored Glycine 0 CA--C 1.532 1.1 0 CA-C-N 115.004 -0.998 . . . . 0.0 114.366 165.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.509 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 4.0 m -62.0 -46.35 89.61 Favored 'General case' 0 C--O 1.244 0.771 0 CA-C-N 118.621 1.21 . . . . 0.0 110.061 177.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' HB2' ' HG ' ' A' ' 23' ' ' LEU . . . -80.28 1.74 27.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.006 -175.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.628 HG13 HD21 ' A' ' 7' ' ' ASN . 1.9 tp -62.54 -26.91 41.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 173.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.414 ' OD1' ' HB3' ' A' ' 56' ' ' ALA . 62.9 t30 -147.32 86.07 1.61 Allowed 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.394 174.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.435 ' HB3' HD21 ' A' ' 23' ' ' LEU . 16.3 p -101.75 -45.28 5.28 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.524 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.523 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 1.2 mt -70.24 -44.48 68.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.992 0.425 . . . . 0.0 111.49 -173.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.414 ' HB3' ' OD1' ' A' ' 53' ' ' ASN . . . -80.67 -13.2 59.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 -175.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.595 ' HA ' HG11 ' A' ' 61' ' ' VAL . 98.9 m -83.09 -36.75 24.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.164 173.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.439 ' HD2' ' HG2' ' A' ' 22' ' ' GLU . 25.0 mtpp -71.52 -21.43 61.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.56 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 53.4 mt -65.35 -65.67 0.64 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.373 175.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -175.45 113.11 0.13 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.314 -176.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.595 HG11 ' HA ' ' A' ' 57' ' ' THR . 12.0 p -175.38 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.594 0.712 . . . . 0.0 111.408 -177.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.705 ' HA ' ' HB3' ' A' ' 69' ' ' HIS . 2.4 m -103.66 120.9 54.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 O-C-N 120.888 -1.132 . . . . 0.0 111.088 -177.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.33 -56.18 5.51 Favored Pre-proline 0 CA--C 1.534 0.36 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.74 177.018 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.619 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.0 Cg_endo -97.06 -139.21 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 123.228 2.619 . . . . 0.0 112.761 -171.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.421 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 65.0 m-20 -75.67 11.94 1.19 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.404 -173.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.32 -71.6 0.5 Allowed Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -174.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.619 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.0 p-10 -77.51 156.03 31.26 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.824 -0.688 . . . . 0.0 111.542 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 69.75 41.39 1.21 Allowed 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.382 0.611 . . . . 0.0 111.833 173.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.705 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 5.5 p80 -78.25 80.11 4.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.15 177.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -86.88 -62.59 1.47 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.055 -178.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.07 -54.75 35.43 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 121.482 -0.389 . . . . 0.0 112.685 -177.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -56.08 -34.66 66.18 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.626 0.251 . . . . 0.0 111.347 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.531 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -66.91 -35.78 80.78 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.246 0.545 . . . . 0.0 111.006 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.57 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.5 mmmt -79.79 -40.01 29.58 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.316 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -64.59 -39.73 94.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.812 0.339 . . . . 0.0 110.276 176.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -57.88 -40.85 81.27 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.541 175.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.38 -39.04 78.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.716 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.57 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 56.2 mtt -69.93 -39.45 76.1 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.001 0.429 . . . . 0.0 111.189 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -89.08 -9.34 51.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.96 0.409 . . . . 0.0 110.556 -175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -143.69 91.24 2.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.627 -0.261 . . . . 0.0 110.411 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 118.3 -76.43 0.29 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.565 175.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.718 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.04 137.02 33.32 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.653 0.264 . . . . 0.0 110.697 -176.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -79.2 154.96 28.85 Favored 'General case' 0 CA--C 1.498 -1.055 0 CA-C-O 121.369 0.604 . . . . 0.0 109.762 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -63.39 -43.83 96.46 Favored 'General case' 0 N--CA 1.416 -2.17 0 CA-C-N 114.615 -1.175 . . . . 0.0 110.985 -167.162 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.572 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 2.8 m -51.57 -45.68 63.19 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.863 174.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 2.7 ptm -76.32 -39.33 54.35 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.413 0.625 . . . . 0.0 109.419 -177.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -61.03 -36.38 79.38 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.02 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.734 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.7 mp0 -70.8 -25.27 62.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.976 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 85' ' ' THR . 29.4 mm-40 -78.08 -24.46 47.63 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 175.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.528 ' O ' HG13 ' A' ' 94' ' ' ILE . 23.4 tp -87.23 -46.16 9.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.683 179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.734 HG22 ' HA ' ' A' ' 88' ' ' GLN . 5.2 m -60.89 -28.51 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 -176.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -63.85 -44.17 93.95 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.65 HG12 ' HA ' ' A' ' 118' ' ' PHE . 1.8 mp -67.52 -41.45 85.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.118 176.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.528 HG13 ' O ' ' A' ' 90' ' ' LEU . 54.5 mt -57.5 -46.95 85.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.247 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 48.4 m170 -70.14 -33.85 72.32 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.418 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.08 -54.93 3.23 Favored Glycine 0 N--CA 1.444 -0.81 0 C-N-CA 120.151 -1.023 . . . . 0.0 112.263 -173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.0 m -72.97 -31.39 64.5 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.434 ' HB2' HG11 ' A' ' 114' ' ' VAL . 42.3 tt0 -68.13 -36.39 79.63 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 119.456 1.025 . . . . 0.0 110.789 171.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' A' ' 99' ' ' LYS . 23.9 ttpp -64.27 -43.21 95.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 120.918 0.39 . . . . 0.0 110.858 177.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 70.2 m -104.1 25.53 9.89 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.437 -178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -68.25 155.42 92.36 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.297 178.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.439 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 50.8 Cg_exo -53.7 155.23 14.3 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.594 2.196 . . . . 0.0 111.699 176.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 15.1 Cg_exo -70.22 24.64 0.19 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.232 2.621 . . . . 0.0 113.191 -177.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 102' ' ' PRO . 85.2 m-20 -105.4 93.37 4.64 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -79.5 95.43 5.82 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.816 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 9.3 t0 -105.56 120.39 41.53 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.077 178.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -29.03 -73.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 O-C-N 125.312 1.633 . . . . 0.0 113.689 -176.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.488 ' O ' HG22 ' A' ' 111' ' ' THR . 18.0 t -97.68 -7.26 31.29 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.816 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.4 ttt -82.56 -28.2 31.1 Favored 'General case' 0 C--O 1.251 1.134 0 O-C-N 121.417 -0.802 . . . . 0.0 113.005 -168.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.662 ' HG2' ' N ' ' A' ' 111' ' ' THR . 0.2 OUTLIER -56.94 -45.15 82.96 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 121.929 0.871 . . . . 0.0 110.736 -173.125 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.662 ' N ' ' HG2' ' A' ' 110' ' ' LYS . 14.6 t -58.87 -10.59 2.53 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 0.0 113.126 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.807 HD11 ' HA3' ' A' ' 49' ' ' GLY . 1.2 mp -91.5 -39.56 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 175.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -58.23 -38.87 77.7 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.222 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.654 HG22 ' HA ' ' A' ' 111' ' ' THR . 6.3 m -84.88 -31.38 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 CA-C-O 121.416 0.627 . . . . 0.0 110.041 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.12 -46.35 90.93 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.246 173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.557 ' HG2' ' O ' ' A' ' 112' ' ' ILE . 19.3 ptt? -67.95 -20.45 65.06 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.111 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.917 ' HA ' ' HE3' ' A' ' 120' ' ' LYS . 21.4 t -68.69 -30.26 68.89 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.482 0.658 . . . . 0.0 109.263 174.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.65 ' HA ' HG12 ' A' ' 93' ' ' ILE . 71.6 t80 -77.16 -49.37 15.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.298 -178.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.516 ' HE3' ' C ' ' A' ' 119' ' ' LYS 0.254 0.0 OUTLIER -70.96 -16.55 62.66 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.072 177.757 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.917 ' HE3' ' HA ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -62.26 -54.38 41.61 Favored 'General case' 0 N--CA 1.462 0.168 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 169.303 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -58.72 -48.96 79.36 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 115.514 -0.767 . . . . 0.0 112.343 174.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -33.99 48.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 122.002 -0.436 . . . . 0.0 111.326 178.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -71.98 -31.61 66.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.96 -0.463 . . . . 0.0 111.767 174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -66.6 -37.44 84.9 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 120.924 0.392 . . . . 0.0 110.527 175.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 70.2 mt -66.94 -36.47 82.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.848 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.9 t30 72.46 120.09 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.337 1.065 . . . . 0.0 112.082 176.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 19.8 p-90 -135.19 22.4 3.48 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.61 177.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 58.4 t 71.28 90.23 0.08 OUTLIER Pre-proline 0 C--O 1.234 0.249 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.821 -170.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.54 162.08 43.76 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 123.171 2.581 . . . . 0.0 111.86 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -117.44 -74.24 0.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.857 -176.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . 0.776 ' H ' ' HB3' ' A' ' 40' ' ' ASP . 23.6 ptt? 35.55 75.33 0.06 Allowed 'General case' 0 N--CA 1.47 0.527 0 O-C-N 124.273 0.983 . . . . 0.0 112.157 -175.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -80.52 105.68 11.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.739 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 55.5 tp -74.45 104.81 5.31 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.358 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 34.6 m -84.35 2.1 4.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.032 178.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm 73.42 124.6 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -76.8 -149.91 3.34 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.684 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -155.47 129.74 8.9 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 122.369 -0.489 . . . . 0.0 111.143 179.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 95.4 t -87.39 135.9 24.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.461 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.724 ' H ' HD23 ' A' ' 139' ' ' LEU . 2.1 pt? -111.88 113.44 25.77 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 174.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -121.12 158.1 28.66 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.787 -175.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -141.41 165.4 27.62 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.707 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.245 0.846 0 CA-C-O 119.014 -0.517 . . . . 0.0 110.601 178.956 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.444 ' HB2' ' OE1' ' A' ' 3' ' ' GLU . 26.1 p . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 110.456 -0.201 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.649 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 13.0 Cg_endo -57.96 -21.48 49.93 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.858 2.372 . . . . 0.0 112.8 179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.444 ' OE1' ' HB2' ' A' ' 1' ' ' SER . 2.3 mp0 -54.04 -69.7 0.12 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.127 174.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.6 tp -73.91 -13.43 15.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 121.19 0.519 . . . . 0.0 110.926 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.649 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 24.3 ttt -72.39 -29.97 64.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.059 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -81.52 96.84 7.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.44 178.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.461 HD21 HG23 ' A' ' 52' ' ' ILE . 25.8 t-20 -66.55 128.46 36.3 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 174.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD11 ' O ' ' A' ' 80' ' ' HIS . 22.2 mt -54.94 -45.64 74.88 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -176.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -66.12 -35.51 80.69 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.453 0.168 . . . . 0.0 110.914 -178.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -70.45 -36.68 74.08 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.136 0.493 . . . . 0.0 110.482 177.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -67.3 -55.36 14.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.907 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 31.2 m-85 -50.41 -77.48 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.49 -0.777 . . . . 0.0 113.036 173.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.06 35.69 54.78 Favored Glycine 0 C--N 1.342 0.911 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.188 -173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 14' ' ' LYS . 9.0 tmtt? -85.44 -36.81 20.39 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.985 0.422 . . . . 0.0 110.155 -176.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.55 88.38 2.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.28 0.562 . . . . 0.0 110.873 -176.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 60.6 mtm -82.53 -45.62 14.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.256 -0.883 . . . . 0.0 110.051 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -60.24 -44.61 95.1 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.119 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 3.7 mm100 -87.23 -21.05 26.08 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 119.907 -0.717 . . . . 0.0 111.279 -171.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -75.72 -31.9 59.83 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 170.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.514 ' HA ' HD12 ' A' ' 25' ' ' LEU . 27.5 tptp -57.8 -55.39 35.51 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.49 178.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -73.85 -39.57 63.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.09 -177.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 19.1 tt0 -70.35 -32.73 70.56 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -172.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.485 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -83.8 -1.16 53.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.019 0.438 . . . . 0.0 110.08 178.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 34.7 t 63.81 29.06 14.8 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.901 -177.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.669 HD21 ' HB2' ' A' ' 51' ' ' ALA . 21.3 mt -70.62 128.34 91.11 Favored Pre-proline 0 N--CA 1.45 -0.44 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.521 -172.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 57.6 Cg_endo -79.76 151.92 22.11 Favored 'Trans proline' 0 N--CA 1.443 -1.488 0 C-N-CA 121.798 1.666 . . . . 0.0 108.847 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.45 -31.83 66.31 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.871 -176.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.6 p -65.06 -52.81 53.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.653 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.571 HG23 ' HG2' ' A' ' 26' ' ' PRO . 90.0 t -69.5 -50.1 53.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -175.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.556 ' HB ' ' HB3' ' A' ' 25' ' ' LEU . 9.6 p -61.18 -32.75 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.827 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.05 -46.67 50.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 120.953 0.406 . . . . 0.0 111.12 177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -62.28 -38.25 88.64 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.182 -178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.578 HD13 ' HB1' ' A' ' 48' ' ' ALA . 23.4 tp -55.7 -56.86 15.47 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.855 171.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.2 m-30 -68.59 11.64 0.17 Allowed 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -52.12 125.44 15.68 Favored 'General case' 0 C--N 1.353 0.753 0 CA-C-N 120.24 1.382 . . . . 0.0 110.223 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -70.21 -33.68 71.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.631 -175.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.9 m-90 -90.5 142.91 27.26 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.561 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -75.8 78.21 2.73 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.42 0.629 . . . . 0.0 110.918 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -42.83 -46.72 5.36 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.759 173.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 70.42 32.25 2.78 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 121.835 0.826 . . . . 0.0 110.112 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.28 175.69 9.49 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.363 -1.29 . . . . 0.0 110.836 175.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.0 t -90.95 127.3 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 169.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.9 ttm -69.31 94.38 0.71 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.181 0.515 . . . . 0.0 109.797 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 p -85.01 -36.26 21.4 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.141 -174.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.542 ' OD1' ' HB3' ' A' ' 47' ' ' LEU . 5.8 t70 -87.04 117.0 25.48 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.754 0.788 . . . . 0.0 110.597 -178.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.63 ' HD2' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -53.39 -37.5 62.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.354 175.612 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.664 HD21 ' HD3' ' A' ' 26' ' ' PRO . 33.4 tp -68.92 -14.87 63.3 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.234 0.54 . . . . 0.0 111.013 -172.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.578 ' HB1' HD13 ' A' ' 33' ' ' LEU . . . -76.74 -54.83 6.11 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 174.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -37.94 -47.17 1.85 Allowed Glycine 0 CA--C 1.531 1.056 0 CA-C-N 114.861 -1.063 . . . . 0.0 114.505 166.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 47' ' ' LEU . 5.9 m -63.16 -45.02 93.83 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 118.242 1.021 . . . . 0.0 110.645 179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.669 ' HB2' HD21 ' A' ' 25' ' ' LEU . . . -72.34 -11.41 60.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.276 -176.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.461 HG23 HD21 ' A' ' 7' ' ' ASN . 67.6 mt -58.67 -39.03 74.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 121.091 0.472 . . . . 0.0 109.846 173.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.58 84.81 2.3 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.597 0.713 . . . . 0.0 110.425 179.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 7.3 t -116.32 -48.26 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.751 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.32 -48.29 23.8 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.225 0.536 . . . . 0.0 111.484 -172.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HB1' ' HZ ' ' A' ' 76' ' ' PHE . . . -81.01 -15.61 55.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.366 0.603 . . . . 0.0 109.958 -174.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.783 HG23 HG11 ' A' ' 61' ' ' VAL . 55.4 m -80.71 -35.89 32.91 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.267 174.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtpt -71.8 -22.46 61.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 8.6 mt -63.67 -64.04 1.01 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.059 175.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -175.24 119.86 0.19 Allowed 'General case' 0 CA--C 1.518 -0.263 0 N-CA-C 110.058 -0.349 . . . . 0.0 110.058 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.783 HG11 HG23 ' A' ' 57' ' ' THR . 10.4 p -171.11 32.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.645 0.736 . . . . 0.0 111.096 -175.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.627 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 1.3 m -108.12 122.08 62.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 O-C-N 121.037 -1.04 . . . . 0.0 111.2 -175.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -53.58 2.77 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.013 177.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.649 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 22.7 Cg_endo -99.72 -139.43 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 123.08 2.52 . . . . 0.0 113.326 -172.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 35.5 t70 -72.9 10.67 0.83 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.477 -173.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 128.75 -67.84 0.55 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.203 -0.998 . . . . 0.0 111.523 -173.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.728 HD22 HD23 ' A' ' 68' ' ' LEU . 2.8 p-10 -82.37 154.93 24.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.95 -0.625 . . . . 0.0 111.243 -178.247 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.728 HD23 HD22 ' A' ' 67' ' ' ASN . 4.4 mm? 69.32 38.57 1.82 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.228 173.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.627 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 14.3 p80 -75.78 81.06 2.71 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.371 0.605 . . . . 0.0 111.233 177.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 41.6 t60 -86.41 -61.67 1.69 Allowed 'General case' 0 C--O 1.241 0.63 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.744 -177.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.97 -56.37 25.11 Favored Glycine 0 CA--C 1.508 -0.378 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.79 -175.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 32.8 t-20 -55.49 -29.63 59.14 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 123.712 0.301 . . . . 0.0 111.44 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.565 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -73.74 -36.51 65.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.36 0.6 . . . . 0.0 111.235 -176.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.588 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.2 mmmt -79.18 -39.8 32.46 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.439 ' O ' ' HD2' ' A' ' 79' ' ' LYS . 21.4 t70 -60.7 -41.02 94.37 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.417 -0.811 . . . . 0.0 109.976 174.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.609 ' HZ ' ' HB1' ' A' ' 56' ' ' ALA . 54.3 t80 -56.44 -42.78 78.68 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.084 178.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.37 -25.19 63.15 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.483 -0.487 . . . . 0.0 111.264 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.588 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 48.4 mtt -68.39 -39.48 81.69 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.357 178.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HD2' ' O ' ' A' ' 75' ' ' ASP . 0.0 OUTLIER -93.41 -7.84 43.46 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.466 178.001 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.499 ' O ' HD11 ' A' ' 8' ' ' LEU . 43.9 m-70 -134.71 89.21 2.51 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.889 -0.324 . . . . 0.0 110.711 176.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 123.32 -68.65 0.47 Allowed Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.329 -0.939 . . . . 0.0 112.9 171.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.1 150.48 20.79 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.032 0.444 . . . . 0.0 111.478 -175.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.63 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 5.5 m-20 -76.66 151.22 36.24 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 172.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.11 -32.69 69.34 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.151 -168.06 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.26 -28.63 65.11 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.848 174.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 20.1 mtm -88.24 -41.59 12.84 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 -176.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.592 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -58.82 -39.24 80.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.442 171.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.516 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.9 mp0 -74.85 -27.16 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 122.642 0.377 . . . . 0.0 111.776 -175.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 86' ' ' MET . 30.0 pt20 -80.99 -22.81 39.18 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.117 -0.633 . . . . 0.0 109.589 172.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.501 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.0 OUTLIER -83.42 -42.19 17.25 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.911 -179.149 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 87' ' ' ALA . 18.6 m -57.59 -32.47 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -176.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.22 -45.12 95.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.158 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.622 HG23 ' SG ' ' A' ' 117' ' ' CYS . 3.3 mm -65.84 -44.16 92.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.53 174.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 90' ' ' LEU . 56.5 mt -52.72 -47.8 50.04 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.308 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.771 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 43.1 m170 -70.19 -34.75 73.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.424 -176.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.52 -52.36 3.98 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.59 -173.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 4.6 m -72.29 -32.19 66.39 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 119.041 -0.504 . . . . 0.0 111.924 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.543 ' HB2' HG11 ' A' ' 114' ' ' VAL . 34.0 tt0 -67.86 -38.41 83.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.959 0.8 . . . . 0.0 110.411 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -65.62 -43.54 89.24 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.941 0.4 . . . . 0.0 110.49 176.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 8.9 t -96.01 16.99 16.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.046 -176.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.39 151.42 91.93 Favored Pre-proline 0 C--N 1.325 -0.48 0 N-CA-C 110.137 -0.319 . . . . 0.0 110.137 178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.445 ' C ' ' H ' ' A' ' 104' ' ' ASN . 52.5 Cg_exo -53.51 156.64 10.85 Favored 'Trans proline' 0 CA--C 1.533 0.437 0 C-N-CA 122.779 2.319 . . . . 0.0 112.156 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -69.07 24.94 0.15 Allowed 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.062 2.508 . . . . 0.0 113.265 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 102' ' ' PRO . 67.5 m-20 -90.17 93.91 9.55 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 177.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -80.94 96.55 7.11 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.05 -177.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.916 ' HB3' ' HB3' ' A' ' 109' ' ' MET . 11.9 t70 -122.32 105.87 10.58 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 169.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -29.26 -58.49 0.15 Allowed 'General case' 0 N--CA 1.473 0.692 0 O-C-N 124.954 1.409 . . . . 0.0 114.116 -177.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.8 t -93.98 -12.69 28.16 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.89 -0.506 . . . . 0.0 112.246 -173.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.916 ' HB3' ' HB3' ' A' ' 106' ' ' ASP . 15.3 ttt -85.7 -27.62 25.19 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.777 0.799 . . . . 0.0 111.617 -169.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.404 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.14 -39.15 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.257 -177.433 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.35 -16.82 9.94 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.685 174.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.588 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.8 mp -87.73 -36.0 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 176.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -58.86 -36.2 74.22 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.781 177.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.543 HG11 ' HB2' ' A' ' 98' ' ' GLU . 8.5 m -80.21 -38.35 18.22 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 O-C-N 121.919 -0.488 . . . . 0.0 110.758 177.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.89 -46.92 88.71 Favored 'General case' 0 C--O 1.24 0.591 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.864 -179.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.797 ' HA ' ' HE3' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.18 -21.02 60.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.775 178.219 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.622 ' SG ' HG23 ' A' ' 93' ' ' ILE . 11.2 t -66.92 -28.68 68.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 0.0 109.804 171.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -81.04 -48.16 12.6 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.916 -176.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.797 ' HE3' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -70.1 -29.25 66.17 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 118.473 -1.291 . . . . 0.0 110.404 -179.873 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 116' ' ' MET . 11.0 ttmt -55.4 -54.85 38.63 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.24 170.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.593 ' HG2' ' O ' ' A' ' 117' ' ' CYS . 19.9 mm-40 -57.76 -51.59 68.94 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.609 179.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.8 tt -59.33 -33.16 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 CA-C-N 118.034 0.379 . . . . 0.0 111.53 -179.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -71.96 -30.72 65.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.314 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -74.13 -35.84 64.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.072 -178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -87.6 8.33 25.71 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 174.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.447 HD22 ' N ' ' A' ' 126' ' ' ASN . 0.9 OUTLIER 64.47 168.34 0.17 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.355 0.598 . . . . 0.0 111.542 -176.771 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 3.1 p90 -109.87 -177.16 3.19 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.435 -173.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.551 ' HB ' ' HD2' ' A' ' 129' ' ' PRO . 26.8 m -78.39 172.51 9.67 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.092 177.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.551 ' HD2' ' HB ' ' A' ' 128' ' ' VAL . 70.3 Cg_exo -54.43 94.34 0.04 OUTLIER 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.383 2.056 . . . . 0.0 113.203 174.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 22.4 p-10 -168.95 -171.14 1.27 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 174.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 59.0 mtt -118.35 102.05 8.65 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 177.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -79.62 111.01 15.49 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.1 mp -100.9 29.59 4.5 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.391 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 4.8 t -103.69 13.35 7.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.856 0.836 . . . . 0.0 109.252 178.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.533 HD13 ' H ' ' A' ' 135' ' ' ILE . 0.2 OUTLIER -74.69 17.73 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.323 177.921 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -91.17 41.83 2.88 Favored Glycine 0 N--CA 1.445 -0.724 0 N-CA-C 110.998 -0.841 . . . . 0.0 110.998 177.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.61 111.85 0.8 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.087 -0.557 . . . . 0.0 110.31 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 5.7 m -70.78 102.53 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.714 0.768 . . . . 0.0 111.934 -175.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.74 93.91 6.29 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -91.46 97.22 10.94 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.795 -177.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -95.06 -86.77 0.29 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.546 176.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 23.9 t . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.337 177.656 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.4 t . . . . . 0 N--CA 1.48 1.064 0 CA-C-O 120.764 0.316 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.626 ' HA ' ' HB2' ' A' ' 5' ' ' MET . 96.9 Cg_endo -81.17 2.17 8.76 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.975 2.45 . . . . 0.0 113.206 -177.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -50.11 -69.2 0.12 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.622 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.6 tp -73.45 -10.89 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 121.38 0.609 . . . . 0.0 111.101 -178.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.626 ' HB2' ' HA ' ' A' ' 2' ' ' PRO . 77.0 mtp -79.31 -21.71 45.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.552 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -81.1 80.98 7.45 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.203 0.525 . . . . 0.0 109.601 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 48.0 t-20 -62.12 134.09 56.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.356 -177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.534 HD21 ' HB3' ' A' ' 80' ' ' HIS . 7.0 mp -54.9 -45.86 74.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.807 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -63.9 -32.63 74.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.84 -178.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -74.98 -35.97 62.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.147 179.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.93 -45.91 69.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.02 176.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 23.2 m-85 -46.76 -77.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.565 170.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 50.09 38.66 32.53 Favored Glycine 0 C--N 1.342 0.884 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.173 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -63.81 -55.56 22.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.021 0.439 . . . . 0.0 110.613 -177.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.5 105.37 4.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 66.3 mtt -70.52 -37.15 74.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.711 179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.74 -28.74 69.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.511 -178.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 22' ' ' GLU . 17.8 mm-40 -88.66 -27.18 21.44 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.075 -0.65 . . . . 0.0 111.226 -173.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 t -74.51 -35.02 63.17 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 1.026 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.1 OUTLIER -59.32 -51.28 70.63 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.425 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -73.76 -32.31 63.75 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.406 -175.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -68.16 -44.82 75.1 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.633 0.254 . . . . 0.0 110.844 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.687 ' HB2' HD22 ' A' ' 25' ' ' LEU . 10.5 mt -83.43 -17.29 42.65 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.042 0.449 . . . . 0.0 110.677 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.0 t 66.05 37.97 5.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.587 -177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 1.026 HD23 ' HA ' ' A' ' 20' ' ' LYS . 2.2 mm? -51.04 135.75 28.72 Favored Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.139 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.566 ' HD3' ' HG ' ' A' ' 47' ' ' LEU . 23.9 Cg_exo -65.28 149.65 88.25 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.909 1.739 . . . . 0.0 109.504 166.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -60.13 -32.66 71.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.673 0.273 . . . . 0.0 111.017 -174.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 t -70.01 -40.54 75.18 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.907 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 43.7 t -71.44 -53.14 21.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.392 -176.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.712 HG21 ' HG2' ' A' ' 20' ' ' LYS . 9.9 p -60.34 -36.51 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.75 0.309 . . . . 0.0 110.804 -178.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.34 -51.52 56.4 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.205 177.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.02 -37.85 88.94 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.229 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 19.5 tp -54.36 -56.62 16.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.796 173.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -68.97 11.66 0.19 Allowed 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -59.13 130.55 47.51 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 119.926 1.239 . . . . 0.0 110.12 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -70.34 -35.02 73.34 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.794 -176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.4 m-90 -84.44 136.98 33.62 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.559 ' HD2' ' N ' ' A' ' 38' ' ' LYS . 3.3 mptp? -85.24 75.21 10.31 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.891 -171.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 41' ' ' TYR . 17.4 t70 -44.04 -55.38 4.73 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.076 -0.965 . . . . 0.0 112.291 172.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 34.9 t70 75.28 35.5 0.57 Allowed 'General case' 0 C--N 1.348 0.529 0 CA-C-O 121.899 0.857 . . . . 0.0 110.386 173.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.483 ' HB3' ' OD2' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -77.67 178.01 7.66 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.054 -0.975 . . . . 0.0 110.828 175.804 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 39.9 t -84.61 114.8 25.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 174.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 48.7 ttm -66.71 102.22 0.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.833 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -99.44 -34.8 10.13 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.211 -0.449 . . . . 0.0 112.104 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -69.88 117.32 11.32 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.928 0.87 . . . . 0.0 110.791 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.712 ' HD2' ' N ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER -47.94 -36.91 13.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 113.695 -1.593 . . . . 0.0 112.718 174.439 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 25' ' ' LEU . 3.3 mm? -68.5 -20.25 64.57 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.533 -178.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -80.68 -55.6 4.72 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.27 -43.15 1.4 Allowed Glycine 0 CA--C 1.534 1.232 0 CA-C-N 115.021 -0.99 . . . . 0.0 114.629 167.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.429 ' HB3' HD13 ' A' ' 23' ' ' LEU . 3.2 m -79.61 -43.96 21.89 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.656 1.228 . . . . 0.0 112.174 179.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.53 ' HB2' HD11 ' A' ' 25' ' ' LEU . . . -71.08 -23.45 62.12 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.465 0.542 . . . . 0.0 112.465 -173.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 10.7 tp -73.12 -25.2 21.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.943 0.401 . . . . 0.0 110.305 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -127.5 43.63 3.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.24 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.6 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 30.7 p -94.55 -44.51 7.82 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.58 -177.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.409 ' O ' HD23 ' A' ' 59' ' ' LEU . 0.4 OUTLIER -60.88 -46.86 88.93 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -171.019 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.77 -12.27 59.79 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.228 -174.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.541 HG23 HG11 ' A' ' 61' ' ' VAL . 89.4 m -83.75 -33.83 24.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.482 174.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 54' ' ' CYS . 18.6 mmmt -75.08 -23.93 58.1 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.636 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 55' ' ' LEU . 4.4 mm? -64.96 -65.14 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.054 174.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -177.41 116.68 0.1 Allowed 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 -178.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.541 HG11 HG23 ' A' ' 57' ' ' THR . 12.7 p -167.3 33.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 122.133 0.968 . . . . 0.0 110.113 -177.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.654 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 27.3 m -107.59 116.89 52.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.419 -177.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.06 -55.08 5.39 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.301 177.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.603 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 1.2 Cg_endo -91.17 -147.9 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.906 0 C-N-CA 123.078 2.519 . . . . 0.0 112.605 -175.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -74.35 2.76 8.61 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -173.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 148.19 -61.35 0.44 Allowed Glycine 0 N--CA 1.443 -0.845 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.303 -177.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.603 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 0.3 OUTLIER -87.87 164.17 16.02 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.302 -0.449 . . . . 0.0 110.509 -178.475 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.529 HD13 ' O ' ' A' ' 68' ' ' LEU . 0.4 OUTLIER 69.07 28.69 4.99 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.583 0.706 . . . . 0.0 110.745 173.171 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.654 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 9.0 p80 -80.3 67.87 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 O-C-N 121.809 -0.557 . . . . 0.0 111.648 176.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -87.57 -48.43 7.92 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 110.085 176.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -57.54 -51.98 54.58 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.153 -176.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -60.42 -32.7 71.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.716 -0.242 . . . . 0.0 111.3 -179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.476 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -64.88 -36.07 83.18 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE3' HG12 ' A' ' 91' ' ' VAL . 4.4 mmmp? -79.74 -36.35 37.43 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.449 178.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.03 -40.96 95.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.345 176.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -63.57 -37.2 86.43 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.165 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.84 -34.36 73.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.241 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.501 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 65.8 mtm -74.4 -35.78 63.46 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.422 179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -91.13 -9.21 46.38 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.52 -177.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.534 ' HB3' HD21 ' A' ' 8' ' ' LEU . 57.1 m-70 -141.07 89.27 2.23 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.687 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 122.19 -75.12 0.36 Allowed Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.864 174.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -96.96 142.88 28.39 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.952 0.406 . . . . 0.0 111.63 -174.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.596 ' OD2' HG22 ' A' ' 85' ' ' THR . 2.3 p-10 -77.95 159.54 28.77 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 170.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.413 ' CD ' ' H ' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -61.81 -42.31 98.86 Favored 'General case' 0 N--CA 1.423 -1.807 0 CA-C-N 115.066 -0.97 . . . . 0.0 112.132 -162.134 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.596 HG22 ' OD2' ' A' ' 83' ' ' ASP . 1.6 t -54.13 -27.92 36.45 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.85 177.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.623 ' HA ' ' HG2' ' A' ' 89' ' ' GLN . 75.7 mtp -85.28 -39.58 17.56 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 121.449 0.642 . . . . 0.0 109.909 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.666 ' O ' HG13 ' A' ' 91' ' ' VAL . . . -65.78 -31.83 73.03 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.947 175.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.474 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -82.24 -26.39 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.051 -176.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.623 ' HG2' ' HA ' ' A' ' 86' ' ' MET . 26.1 pt20 -78.22 -22.89 47.81 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.52 ' O ' HG13 ' A' ' 94' ' ' ILE . 55.6 tp -75.01 -47.25 30.01 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.974 175.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.666 HG13 ' O ' ' A' ' 87' ' ' ALA . 32.0 m -57.9 -35.81 53.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 CA-C-O 120.857 0.361 . . . . 0.0 111.44 -176.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -62.69 -43.93 97.53 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.521 -177.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.609 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mp -68.28 -42.71 84.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.19 176.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 90' ' ' LEU . 55.9 mt -56.01 -48.14 79.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.122 0.487 . . . . 0.0 110.457 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 28.3 m170 -71.58 -36.43 70.88 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.961 -175.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.56 -44.88 6.31 Favored Glycine 0 N--CA 1.444 -0.79 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.052 -172.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.609 ' SG ' HG23 ' A' ' 93' ' ' ILE . 55.9 m -73.09 -41.7 63.79 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-O 119.321 -0.371 . . . . 0.0 111.35 -178.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 101' ' ' ALA . 4.0 tt0 -66.38 -29.48 69.66 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.982 173.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 58.0 tptt -63.71 -39.82 95.25 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.219 0.533 . . . . 0.0 109.951 173.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.7 m -99.58 15.93 24.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.509 -0.768 . . . . 0.0 111.001 -177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.413 ' HB2' ' HA ' ' A' ' 98' ' ' GLU . . . -77.45 147.73 75.99 Favored Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.272 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 70.3 Cg_exo -52.79 151.89 18.63 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.257 2.638 . . . . 0.0 112.606 -179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 13.9 Cg_exo -70.84 47.1 0.69 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 123.719 2.946 . . . . 0.0 112.907 -179.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -125.57 94.3 4.09 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.369 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -81.54 96.5 7.46 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.101 0.476 . . . . 0.0 111.74 -176.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.517 ' OD1' ' HB2' ' A' ' 109' ' ' MET . 11.6 t70 -112.84 113.81 26.06 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 168.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.579 ' HG2' ' H ' ' A' ' 108' ' ' CYS . 0.9 OUTLIER -33.63 -60.55 0.36 Allowed 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -175.246 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.579 ' H ' ' HG2' ' A' ' 107' ' ' LYS . 5.9 t -91.19 -12.08 36.45 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 118.824 0.738 . . . . 0.0 112.16 -175.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 46' ' ' ARG . 2.9 ttp -81.29 -29.96 34.13 Favored 'General case' 0 C--O 1.246 0.911 0 CA-C-O 122.025 0.917 . . . . 0.0 111.525 -171.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.423 ' H ' ' HG3' ' A' ' 110' ' ' LYS . 0.0 OUTLIER -58.31 -39.11 78.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.565 -179.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -55.96 -15.81 3.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.508 -1.224 . . . . 0.0 112.428 174.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.53 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.2 mp -90.69 -38.57 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 178.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.419 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 0.3 OUTLIER -58.31 -38.26 76.73 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.056 176.33 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.589 HG12 ' HB2' ' A' ' 97' ' ' CYS . 12.8 m -80.86 -35.92 15.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.525 178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.31 81.58 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.63 ' HA ' ' HD2' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -73.52 -19.91 60.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.608 0.718 . . . . 0.0 110.48 178.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.711 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 9.0 t -72.74 -26.4 61.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.583 172.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -80.3 -44.0 20.32 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.54 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.63 ' HD2' ' HA ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -69.48 -28.07 65.76 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.834 179.064 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.711 ' HE3' ' O ' ' A' ' 117' ' ' CYS . 0.0 OUTLIER -61.32 -50.15 74.11 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 171.132 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 124' ' ' LYS . 0.4 OUTLIER -59.18 -47.91 83.56 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 173.005 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 119' ' ' LYS . 0.3 OUTLIER -55.75 -35.7 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 CA-C-N 118.18 0.446 . . . . 0.0 111.266 178.176 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.621 ' HA ' HG11 ' A' ' 128' ' ' VAL . 9.5 m170 -70.9 -32.0 68.82 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 120.82 0.343 . . . . 0.0 111.01 177.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 121' ' ' GLU . 68.3 tttt -66.21 -28.29 68.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.262 176.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 89.9 mt -71.7 0.48 8.7 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.164 175.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 72.86 -56.41 0.66 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.758 . . . . 0.0 112.632 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -67.7 87.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.111 0.481 . . . . 0.0 111.913 -176.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.621 HG11 ' HA ' ' A' ' 123' ' ' HIS . 7.7 p -161.49 130.79 3.19 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.778 177.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 8.8 Cg_exo -73.61 44.1 0.87 Allowed 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.502 2.801 . . . . 0.0 113.355 -178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.433 ' OD1' ' HE1' ' A' ' 123' ' ' HIS . 27.0 t-20 -159.88 135.15 8.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 176.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 25.3 ttt -55.8 135.4 51.83 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.274 0.559 . . . . 0.0 111.941 -177.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -83.35 130.54 35.06 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.53 175.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -160.74 108.65 1.57 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . . . . . . . . . 14.9 p -123.43 147.24 27.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 175.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.429 HD12 ' N ' ' A' ' 135' ' ' ILE . 3.7 mp -95.75 108.36 20.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -73.83 89.38 0.66 Allowed Glycine 0 N--CA 1.448 -0.557 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.632 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -61.96 138.56 58.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.016 0.436 . . . . 0.0 111.221 -178.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.54 93.91 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.274 174.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.6 tt -76.31 96.54 4.0 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 177.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -71.19 136.55 48.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.807 -178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -123.91 171.99 9.27 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.64 -179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 58.9 t . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.448 -0.787 . . . . 0.0 110.17 179.494 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.8 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 7.0 m . . . . . 0 N--CA 1.481 1.091 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.825 ' HA ' ' HB3' ' A' ' 5' ' ' MET . 34.6 Cg_exo -59.69 -17.78 44.44 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 122.699 2.266 . . . . 0.0 114.377 -174.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.528 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.8 mp0 -45.68 -69.59 0.13 Allowed 'General case' 0 N--CA 1.471 0.606 0 O-C-N 123.485 0.491 . . . . 0.0 111.341 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 82' ' ' ALA . 7.6 tp -87.26 -9.48 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.709 177.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.825 ' HB3' ' HA ' ' A' ' 2' ' ' PRO . 17.4 tmm? -65.48 -36.17 83.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.923 -176.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.42 ' NZ ' ' HB3' ' A' ' 6' ' ' LYS . 8.8 mtpm? -86.51 97.45 10.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.025 0.44 . . . . 0.0 110.212 177.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -67.36 140.68 57.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.141 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mp -58.82 -38.98 79.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.052 178.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 4.9 m -58.51 -35.84 72.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.969 0.414 . . . . 0.0 110.805 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -75.39 -33.73 61.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.526 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -68.87 -56.59 7.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.318 176.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -52.19 -77.3 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.227 0.825 . . . . 0.0 113.227 176.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.55 36.93 59.52 Favored Glycine 0 C--N 1.341 0.86 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.564 -170.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 54.6 tttp -84.97 -40.45 16.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.048 0.452 . . . . 0.0 110.666 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -145.48 59.43 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.688 -176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 16.1 tpt -70.11 -39.71 75.33 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.196 0.522 . . . . 0.0 110.263 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -61.2 -30.14 70.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.809 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -88.78 -20.52 24.63 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.01 -0.676 . . . . 0.0 111.919 -174.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -75.21 -32.55 61.22 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 168.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.972 ' HD2' ' HB2' ' A' ' 25' ' ' LEU . 26.2 tptp -61.32 -47.92 83.74 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.443 175.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -72.77 -38.16 67.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.802 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -61.12 -41.71 97.2 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.895 0.378 . . . . 0.0 110.79 -176.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.485 ' HB3' HD11 ' A' ' 47' ' ' LEU . 12.9 mt -86.6 -10.89 52.95 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.722 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t 57.55 41.68 25.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.55 -174.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.972 ' HB2' ' HD2' ' A' ' 20' ' ' LYS . 16.2 mt -51.28 119.82 13.34 Favored Pre-proline 0 N--CA 1.462 0.168 0 CA-C-N 115.012 -0.994 . . . . 0.0 110.878 -177.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.664 ' HD3' HD21 ' A' ' 47' ' ' LEU . 13.7 Cg_exo -72.24 157.94 52.77 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.751 2.301 . . . . 0.0 110.815 171.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.559 ' HA ' HG22 ' A' ' 30' ' ' VAL . 7.7 p-10 -65.17 -27.22 68.55 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -175.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.1 m -68.82 -39.64 79.93 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.902 0.382 . . . . 0.0 110.516 176.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.868 HG21 HD23 ' A' ' 47' ' ' LEU . 58.0 t -72.33 -44.52 63.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.613 -178.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 27' ' ' ASP . 11.1 m -59.87 -31.7 48.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 110.566 175.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.65 -52.12 58.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.948 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -67.34 -36.37 81.28 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.32 -56.93 13.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.365 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -69.04 10.56 0.28 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -66.27 103.81 1.07 Allowed 'General case' 0 C--N 1.344 0.344 0 CA-C-N 120.108 1.322 . . . . 0.0 110.178 -179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -71.0 -32.37 69.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.109 -175.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.7 m-90 -90.23 101.9 14.62 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.586 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.501 ' HB2' ' NZ ' ' A' ' 38' ' ' LYS . 0.1 OUTLIER -72.64 79.69 1.09 Allowed 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.599 0.714 . . . . 0.0 110.443 179.248 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.81 12.89 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.49 -1.232 . . . . 0.0 114.056 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 32.0 t70 60.02 70.89 0.6 Allowed 'General case' 0 C--N 1.343 0.321 0 CA-C-N 118.695 0.68 . . . . 0.0 110.176 -168.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -115.52 176.35 5.11 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.762 177.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 22.7 t -108.89 121.62 62.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 176.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 50.1 ttm -77.68 100.65 6.28 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.4 p -94.21 -29.92 14.85 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.165 -177.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -78.0 115.06 17.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 121.677 0.751 . . . . 0.0 110.13 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.915 ' HB2' ' HB2' ' A' ' 108' ' ' CYS . 0.0 OUTLIER -57.27 -35.2 69.48 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 114.323 -1.308 . . . . 0.0 111.921 174.527 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.868 HD23 HG21 ' A' ' 29' ' ' VAL . 56.5 tp -64.92 -17.81 64.67 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-O 120.978 0.418 . . . . 0.0 110.795 -174.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -83.12 -61.67 1.8 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -39.03 -45.66 2.24 Favored Glycine 0 CA--C 1.536 1.378 0 CA-C-N 115.215 -0.902 . . . . 0.0 114.672 166.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 86.7 m -64.33 -42.64 96.18 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.307 1.053 . . . . 0.0 110.408 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.85 -25.11 67.76 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.718 0.294 . . . . 0.0 111.646 -178.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 69.1 mt -73.35 -35.57 46.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.188 0.518 . . . . 0.0 110.164 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -104.75 44.74 1.0 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.431 -175.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 6.5 t -112.27 -47.95 3.07 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.241 0.459 . . . . 0.0 112.241 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 6.3 tt -64.94 -52.06 58.42 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.34 0.59 . . . . 0.0 111.037 -170.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -80.92 -11.58 59.55 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.273 -173.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.636 ' HA ' HG11 ' A' ' 61' ' ' VAL . 22.5 m -83.36 -35.25 25.28 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.525 175.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -78.1 -17.35 57.04 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.405 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.6 mt -64.91 -66.96 0.48 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.57 172.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -178.29 121.75 0.1 Allowed 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 176.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.636 HG11 ' HA ' ' A' ' 57' ' ' THR . 11.9 p -176.63 34.5 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 121.906 0.86 . . . . 0.0 111.082 -175.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.536 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 33.6 m -108.52 115.5 49.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 O-C-N 121.158 -0.964 . . . . 0.0 111.422 -175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.22 -55.84 2.11 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.009 178.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.569 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 15.9 Cg_endo -97.47 -140.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 122.984 2.456 . . . . 0.0 113.165 -171.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.485 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 16.4 m-20 -72.89 6.71 2.41 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 115.528 -0.76 . . . . 0.0 112.48 -174.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 131.17 -75.35 0.43 Allowed Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 110.709 -0.956 . . . . 0.0 110.709 -173.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.739 HD22 HD23 ' A' ' 68' ' ' LEU . 3.0 p-10 -69.52 153.76 43.01 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.939 -0.63 . . . . 0.0 111.039 176.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.739 HD23 HD22 ' A' ' 67' ' ' ASN . 4.2 mm? 69.82 32.87 3.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.587 173.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.536 ' CB ' ' HA ' ' A' ' 62' ' ' VAL . 7.5 p-80 -73.73 76.28 1.56 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.388 0.613 . . . . 0.0 110.71 171.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -86.39 -59.12 2.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.699 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.7 -52.36 53.52 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.186 -0.53 . . . . 0.0 112.216 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -58.13 -34.4 70.21 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.832 -0.184 . . . . 0.0 111.458 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.601 ' HA ' ' CG2' ' A' ' 61' ' ' VAL . . . -67.83 -36.45 80.37 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.3 0.572 . . . . 0.0 111.184 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 78' ' ' MET . 25.5 mmmt -80.03 -37.66 33.61 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.61 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.28 -40.6 96.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.27 174.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' A' ' 56' ' ' ALA . 51.7 t80 -61.49 -40.56 95.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.45 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.69 -34.28 73.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.96 0.41 . . . . 0.0 111.179 -178.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 53.0 mtt -74.34 -23.7 59.08 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.088 176.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -85.88 -15.49 41.62 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.732 -176.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -146.89 96.71 2.79 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.076 -176.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 112.54 -71.47 0.22 Allowed Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.379 -0.915 . . . . 0.0 112.658 174.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.736 ' HB2' HD13 ' A' ' 4' ' ' ILE . . . -85.06 139.99 31.33 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.487 -177.434 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.496 ' OD2' HG22 ' A' ' 85' ' ' THR . 0.3 OUTLIER -84.04 166.18 17.94 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.361 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.587 ' O ' ' HB2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -70.46 -25.61 63.26 Favored 'General case' 0 N--CA 1.416 -2.168 0 C-N-CA 119.413 -0.915 . . . . 0.0 110.414 -167.564 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.787 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.6 OUTLIER -73.87 -31.11 63.0 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -178.121 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . . . . . . . . . 9.3 tpp -78.54 -48.0 16.14 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 121.82 0.819 . . . . 0.0 108.946 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.582 ' O ' HG22 ' A' ' 91' ' ' VAL . . . -58.73 -36.7 74.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.409 176.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.704 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.6 mp0 -72.14 -25.66 61.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.91 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.787 ' HG2' ' O ' ' A' ' 85' ' ' THR . 14.2 mm-40 -77.77 -25.3 49.0 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' ILE . 1.5 tt -87.89 -43.62 11.66 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.862 -178.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.704 HG22 ' HA ' ' A' ' 88' ' ' GLN . 4.8 m -60.9 -27.89 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 -176.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -66.47 -41.14 89.45 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.462 0.649 . . . . 0.0 109.861 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.531 HG23 ' SG ' ' A' ' 117' ' ' CYS . 1.7 mp -66.46 -39.34 83.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.131 176.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 90' ' ' LEU . 49.3 mt -57.99 -47.39 86.76 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.337 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.146 -179.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -69.71 -34.88 74.52 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.55 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -82.22 -53.09 3.77 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.058 -1.068 . . . . 0.0 112.515 -172.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . . . . . . . . . 12.7 m -72.42 -32.18 66.11 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.539 ' OE2' ' HE2' ' A' ' 110' ' ' LYS . 40.3 tt0 -67.21 -34.72 78.08 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.122 0.874 . . . . 0.0 110.114 173.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -63.67 -41.2 98.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.923 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 46.1 m -103.06 19.57 19.26 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.72 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -76.41 155.7 83.72 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.902 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.49 ' HA ' ' HD3' ' A' ' 103' ' ' PRO . 71.9 Cg_exo -48.41 135.84 26.01 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.692 2.261 . . . . 0.0 111.636 174.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 102' ' ' PRO . 16.2 Cg_exo -70.51 49.32 0.86 Allowed 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 123.686 2.924 . . . . 0.0 113.498 -176.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -125.35 94.37 4.13 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 173.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -81.13 84.96 6.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.087 -171.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.662 ' HB3' ' HB2' ' A' ' 109' ' ' MET . 15.7 t70 -106.94 133.47 51.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.587 176.136 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -30.05 -75.28 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 O-C-N 124.712 1.258 . . . . 0.0 113.711 -175.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.915 ' HB2' ' HB2' ' A' ' 46' ' ' ARG . 98.1 m -88.63 -10.29 49.13 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.518 0.562 . . . . 0.0 112.518 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.662 ' HB2' ' HB3' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -69.61 -41.17 76.06 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 -173.557 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.539 ' HE2' ' OE2' ' A' ' 98' ' ' GLU . 14.3 ptmt -65.19 -51.0 63.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.778 0.799 . . . . 0.0 110.373 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.538 ' HA ' HG22 ' A' ' 114' ' ' VAL . 0.3 OUTLIER -59.56 -14.27 12.49 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.601 -1.181 . . . . 0.0 112.575 174.085 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.59 -36.31 9.46 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 177.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -63.42 -35.26 79.82 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.356 176.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 117' ' ' CYS . 16.0 m -76.36 -37.08 30.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.985 177.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -60.36 -49.21 78.5 Favored 'General case' 0 C--O 1.246 0.882 0 CA-C-O 121.308 0.575 . . . . 0.0 111.367 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.624 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 23.2 ptt? -69.09 -17.68 63.89 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.814 -0.755 . . . . 0.0 110.281 178.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 114' ' ' VAL . 31.8 t -73.54 -30.03 62.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.835 177.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -77.64 -43.23 32.12 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.585 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.578 ' O ' HG22 ' A' ' 122' ' ' ILE . 0.3 OUTLIER -70.42 -23.42 62.74 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.903 176.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.624 ' HE3' ' O ' ' A' ' 116' ' ' MET . 1.1 ttmt -62.23 -48.29 80.63 Favored 'General case' 0 C--N 1.344 0.337 0 O-C-N 121.353 -0.842 . . . . 0.0 110.095 170.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -59.14 -45.0 92.09 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 119' ' ' LYS . 11.8 tt -58.92 -33.41 49.73 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-N 118.799 0.727 . . . . 0.0 110.675 178.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.462 ' HD2' HG23 ' A' ' 122' ' ' ILE . 9.8 m170 -71.1 -31.43 67.79 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.484 -0.486 . . . . 0.0 111.448 174.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -66.39 -35.28 79.93 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 122.527 0.331 . . . . 0.0 111.552 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 122' ' ' ILE . 0.6 OUTLIER -85.28 10.66 11.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -179.067 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 68.86 110.98 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.559 0.695 . . . . 0.0 111.236 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 4.4 p-90 -112.47 -176.78 2.99 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.493 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 129' ' ' PRO . 16.8 m -119.48 131.43 24.39 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.476 177.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 128' ' ' VAL . 23.7 Cg_exo -63.93 159.19 43.34 Favored 'Trans proline' 0 C--O 1.235 0.373 0 C-N-CA 123.001 2.467 . . . . 0.0 112.802 -176.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -105.0 153.0 22.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.05 179.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 60.3 mtt -94.85 -174.13 3.18 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -71.28 119.27 15.18 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.182 178.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.543 HD13 HG22 ' A' ' 134' ' ' VAL . 0.4 OUTLIER -101.54 76.45 1.67 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.096 -178.659 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.543 HG22 HD13 ' A' ' 133' ' ' LEU . 17.3 m 35.56 75.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 124.176 0.99 . . . . 0.0 113.466 178.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.927 HD13 ' H ' ' A' ' 135' ' ' ILE . 0.2 OUTLIER -78.71 102.15 4.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.844 0.831 . . . . 0.0 110.501 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -73.07 160.81 54.17 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 114.777 -1.101 . . . . 0.0 112.345 -179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -115.43 114.13 24.65 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.009 0.433 . . . . 0.0 110.152 -177.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 79.7 t -96.17 121.82 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.762 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 5.9 tt -88.92 110.24 20.92 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -79.15 106.37 11.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.637 -178.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -125.13 143.11 51.09 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.866 178.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.247 0.971 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.208 179.688 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.478 0.94 0 CA-C-O 120.62 0.248 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -86.56 -1.71 8.33 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.963 2.442 . . . . 0.0 112.402 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 mp0 -45.17 -68.11 0.23 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.173 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 6.0 tt -83.14 -9.62 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-O 121.002 0.429 . . . . 0.0 111.433 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 94.2 mmm -66.64 -26.02 66.86 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.203 0.525 . . . . 0.0 109.799 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -92.93 102.47 14.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.234 166.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -62.92 130.05 43.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.972 0.415 . . . . 0.0 110.888 -177.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.537 ' O ' ' HD1' ' A' ' 12' ' ' PHE . 89.6 mt -65.18 -45.04 86.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.598 -176.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 m -60.5 -40.57 91.85 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.769 0.319 . . . . 0.0 110.771 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -75.89 -24.25 55.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.083 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.461 ' C ' HD22 ' A' ' 11' ' ' ASN . 0.2 OUTLIER -73.43 -50.79 19.87 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 175.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' HD1' ' O ' ' A' ' 8' ' ' LEU . 34.9 m-85 -50.24 -77.99 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.353 173.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 54.44 38.52 62.89 Favored Glycine 0 C--N 1.343 0.954 0 C-N-CA 120.915 -0.66 . . . . 0.0 113.717 -177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 89.8 mttt -68.12 -36.79 80.29 Favored 'General case' 0 C--O 1.231 0.088 0 CA-C-N 117.295 0.547 . . . . 0.0 110.512 178.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.29 101.52 3.13 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.629 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 50.9 ttm -70.15 -34.43 73.02 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.105 0.479 . . . . 0.0 109.805 178.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -53.35 -38.73 63.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.279 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -88.29 -25.99 22.51 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.644 -172.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t -75.53 -35.5 60.71 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 172.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.71 -47.94 81.41 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.883 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.73 -37.31 41.66 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.832 -175.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.52 ' HG2' ' HD3' ' A' ' 58' ' ' LYS . 33.9 tp10 -61.45 -41.47 97.26 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.348 0.118 . . . . 0.0 111.025 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.4 mm? -79.05 -22.48 45.3 Favored 'General case' 0 CA--C 1.515 -0.394 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.325 172.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.2 m 58.44 50.54 9.23 Favored 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 -170.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.642 ' CD2' ' HB3' ' A' ' 47' ' ' LEU . 25.4 mt -66.56 121.5 77.49 Favored Pre-proline 0 N--CA 1.462 0.16 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.969 -171.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.557 ' HD2' ' CG2' ' A' ' 29' ' ' VAL . 11.8 Cg_exo -73.3 154.82 51.5 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.558 2.172 . . . . 0.0 110.841 171.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.638 ' HA ' HG22 ' A' ' 30' ' ' VAL . 6.0 p-10 -63.54 -23.6 67.46 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -175.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.2 m -65.79 -39.05 90.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.423 0.63 . . . . 0.0 109.85 175.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.557 ' CG2' ' HD2' ' A' ' 26' ' ' PRO . 58.9 t -70.57 -51.79 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.483 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.638 HG22 ' HA ' ' A' ' 27' ' ' ASP . 16.9 m -57.68 -30.51 37.34 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-O 121.167 0.508 . . . . 0.0 110.731 179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.86 -52.23 57.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.63 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.71 -35.68 65.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.804 178.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 29' ' ' VAL . 19.3 tp -50.53 -55.46 15.98 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.793 177.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.418 ' HD1' ' O ' ' A' ' 30' ' ' VAL . 20.4 m-85 -77.41 11.45 1.97 Allowed 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 -175.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -58.85 111.39 1.27 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 118.28 0.491 . . . . 0.0 109.873 176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -79.05 -17.33 55.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.513 -171.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -91.03 124.71 35.48 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.633 0.254 . . . . 0.0 110.897 -179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -75.96 65.46 2.02 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.736 179.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.718 ' HB3' ' HD2' ' A' ' 41' ' ' TYR . 36.5 t70 -54.89 -19.09 5.84 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 115.771 1.767 . . . . 0.0 115.771 178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 37.9 t70 62.63 70.61 0.55 Allowed 'General case' 0 C--N 1.348 0.517 0 CA-C-N 119.717 1.144 . . . . 0.0 109.59 -169.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.718 ' HD2' ' HB3' ' A' ' 39' ' ' ASP . 7.0 p90 -114.75 165.77 12.46 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.375 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 45.1 t -87.32 117.31 31.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 49.5 ttm -75.1 102.05 4.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.364 179.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 p -107.43 -16.69 14.31 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -176.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -77.98 130.94 37.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.479 . . . . 0.0 110.289 178.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.884 ' HG3' ' HG2' ' A' ' 109' ' ' MET . 3.4 mpt_? -69.99 -27.07 64.41 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.297 -171.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.642 ' HB3' ' CD2' ' A' ' 25' ' ' LEU . 3.7 mm? -80.42 -15.73 56.09 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.053 -173.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.412 ' O ' HG12 ' A' ' 52' ' ' ILE . . . -81.34 -61.12 2.03 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 -177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -38.0 -47.69 1.92 Allowed Glycine 0 CA--C 1.53 0.969 0 CA-C-N 114.846 -1.07 . . . . 0.0 114.073 168.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 m -70.79 -42.5 70.26 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.448 1.124 . . . . 0.0 112.042 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -71.19 -6.28 38.33 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 112.767 0.654 . . . . 0.0 112.767 -177.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 48' ' ' ALA . 45.3 mm -57.02 -30.22 33.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.142 0.496 . . . . 0.0 110.151 172.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.555 HD22 ' N ' ' A' ' 53' ' ' ASN . 0.0 OUTLIER -145.49 86.14 1.74 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.162 -179.106 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 58' ' ' LYS . 23.0 p -112.72 -47.93 3.03 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -177.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.435 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 52.7 tp -64.53 -55.41 20.74 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.076 0.465 . . . . 0.0 112.083 -170.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -81.29 -13.79 58.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.958 0.408 . . . . 0.0 110.268 -173.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.617 HG23 HG11 ' A' ' 61' ' ' VAL . 30.5 m -74.54 -34.85 63.07 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.493 177.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.52 ' HD3' ' HG2' ' A' ' 22' ' ' GLU . 17.5 mmmt -81.17 -24.72 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.222 176.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 55' ' ' LEU . 66.5 mt -64.74 -61.81 1.96 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.135 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -175.09 112.78 0.14 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.545 0.212 . . . . 0.0 110.802 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.617 HG11 HG23 ' A' ' 57' ' ' THR . 9.2 p -170.3 32.24 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 121.969 0.89 . . . . 0.0 110.091 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.548 ' HA ' ' CB ' ' A' ' 69' ' ' HIS . 19.2 m -105.25 120.49 56.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 O-C-N 121.808 -0.557 . . . . 0.0 110.926 -175.192 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.404 ' H ' ' CB ' ' A' ' 69' ' ' HIS . 1.9 t0 -75.39 -55.51 2.12 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.674 175.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.665 ' HG2' ' O ' ' A' ' 67' ' ' ASN . 11.5 Cg_endo -97.26 -143.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 123.112 2.541 . . . . 0.0 113.071 -172.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.511 ' H ' ' HB2' ' A' ' 64' ' ' PRO . 7.6 t70 -72.22 -1.34 14.78 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.593 -175.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 144.14 -68.84 0.42 Allowed Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.164 -0.774 . . . . 0.0 111.164 -175.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.665 ' O ' ' HG2' ' A' ' 64' ' ' PRO . 2.8 p-10 -75.35 149.76 38.59 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.885 -0.657 . . . . 0.0 111.202 -179.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.622 HD23 HD22 ' A' ' 67' ' ' ASN . 4.5 mm? 69.28 37.66 2.03 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.017 172.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.585 ' HA ' ' HD3' ' A' ' 64' ' ' PRO . 10.3 p80 -72.6 80.63 1.09 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.304 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.556 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 28.6 p-80 -87.39 -59.82 2.14 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -62.8 -63.48 4.58 Favored Glycine 0 N--CA 1.462 0.368 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.296 -170.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -57.47 -24.62 56.85 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -177.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 76' ' ' PHE . . . -74.37 -36.07 63.54 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.435 0.636 . . . . 0.0 111.144 178.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.634 ' O ' ' HG3' ' A' ' 78' ' ' MET . 26.1 mmmt -79.48 -33.63 42.06 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.71 -36.83 85.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.578 172.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.464 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 87.7 t80 -57.28 -37.11 71.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.354 175.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.89 75.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.858 175.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 54.1 mtt -66.86 -36.24 81.87 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.901 -175.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 27.7 mmtp -87.63 -14.92 38.73 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.111 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.5 m80 -136.65 89.57 2.47 Favored 'General case' 0 C--N 1.334 -0.101 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.021 -175.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 111.1 -62.04 0.3 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.077 -1.058 . . . . 0.0 112.361 171.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -79.95 132.16 35.98 Favored 'General case' 0 N--CA 1.438 -1.027 0 CA-C-O 121.134 0.492 . . . . 0.0 110.833 -177.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.76 ' HB2' ' HG3' ' A' ' 86' ' ' MET . 91.5 m-20 -75.01 149.42 39.27 Favored 'General case' 0 CA--C 1.488 -1.441 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 174.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -55.97 -33.52 64.87 Favored 'General case' 0 N--CA 1.428 -1.566 0 CA-C-N 113.887 -1.506 . . . . 0.0 110.884 -174.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.39 -26.4 60.08 Favored 'General case' 0 CA--C 1.541 0.623 0 O-C-N 122.344 -0.223 . . . . 0.0 110.94 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' MET . . . . . 0.76 ' HG3' ' HB2' ' A' ' 83' ' ' ASP . 17.9 mtm -86.38 -38.48 17.36 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 -174.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.509 ' CB ' ' HG2' ' A' ' 78' ' ' MET . . . -63.73 -42.6 97.88 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.883 175.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.489 ' HA ' HG22 ' A' ' 91' ' ' VAL . 2.8 mp0 -75.58 -25.61 57.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.119 -176.123 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.97 -23.89 44.23 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.607 174.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 94' ' ' ILE . 60.0 tp -86.51 -48.17 8.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.244 -179.533 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.489 HG22 ' HA ' ' A' ' 88' ' ' GLN . 16.8 m -57.69 -36.34 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 112.307 -174.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -64.02 -42.05 97.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.974 0.416 . . . . 0.0 110.091 -177.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.774 HG23 ' SG ' ' A' ' 97' ' ' CYS . 1.7 mm -65.79 -42.34 92.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.896 175.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.502 HG13 ' O ' ' A' ' 90' ' ' LEU . 58.5 mt -55.43 -47.42 78.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.965 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -70.06 -34.29 73.03 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.439 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -83.55 -44.07 7.06 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.301 -172.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.782 ' HB2' HG12 ' A' ' 114' ' ' VAL . 68.6 m -72.56 -34.4 67.46 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-O 119.35 -0.357 . . . . 0.0 110.942 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.539 ' HG3' HG11 ' A' ' 114' ' ' VAL . 8.3 mt-10 -64.52 -37.54 87.89 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.436 0.562 . . . . 0.0 111.069 170.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -67.38 -41.88 84.32 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.821 0.343 . . . . 0.0 110.512 177.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.4 m -94.68 14.41 21.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.924 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.449 ' HB2' ' O ' ' A' ' 97' ' ' CYS . . . -80.76 150.43 69.44 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.91 159.94 50.97 Favored 'Trans proline' 0 N--CA 1.462 -0.343 0 C-N-CA 122.606 2.204 . . . . 0.0 110.567 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -64.12 84.77 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.337 2.024 . . . . 0.0 111.232 177.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 59.4 t30 -126.29 108.81 11.61 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.992 -176.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -83.37 26.69 0.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 -169.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.465 ' CG ' ' HB2' ' A' ' 109' ' ' MET . 2.8 p30 -89.73 105.29 17.71 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-O 122.467 1.127 . . . . 0.0 111.642 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 37.5 tttp -29.28 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 112.438 -2.165 . . . . 0.0 114.674 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -84.61 -9.97 57.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.659 0.266 . . . . 0.0 111.525 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.884 ' HG2' ' HG3' ' A' ' 46' ' ' ARG . 91.7 mmm -85.12 -21.37 29.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -172.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.568 ' HD2' ' N ' ' A' ' 111' ' ' THR . 0.0 OUTLIER -57.69 -45.31 85.83 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 122.095 0.95 . . . . 0.0 109.975 177.599 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.568 ' N ' ' HD2' ' A' ' 110' ' ' LYS . 0.3 OUTLIER -58.38 -12.49 3.86 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.257 -1.338 . . . . 0.0 112.261 174.227 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . 0.515 ' O ' ' HG3' ' A' ' 116' ' ' MET . 1.3 mp -89.52 -38.85 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.583 ' O ' ' HB2' ' A' ' 117' ' ' CYS . 13.8 m-20 -60.67 -36.94 79.99 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.767 175.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' VAL . . . . . 0.782 HG12 ' HB2' ' A' ' 97' ' ' CYS . 10.9 m -76.77 -38.21 29.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.91 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -62.06 -49.08 77.39 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 121.448 0.642 . . . . 0.0 111.546 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' MET . . . . . 0.692 ' O ' ' HE3' ' A' ' 120' ' ' LYS . 0.0 OUTLIER -69.13 -23.46 63.97 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 119.815 -0.754 . . . . 0.0 109.766 179.034 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' CYS . . . . . 0.583 ' HB2' ' O ' ' A' ' 113' ' ' ASP . 9.3 t -69.43 -26.74 64.75 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 123.344 0.658 . . . . 0.0 109.529 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -75.3 -46.92 30.43 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.262 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.4 ' HA ' ' HB ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -68.53 -25.63 65.02 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 118.345 -1.342 . . . . 0.0 111.15 178.522 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.692 ' HE3' ' O ' ' A' ' 116' ' ' MET . 0.0 OUTLIER -55.37 -56.56 18.75 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 109.878 168.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.483 ' HG3' HD11 ' A' ' 93' ' ' ILE . 20.4 mm-40 -59.94 -42.73 94.66 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.507 176.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.413 HG22 ' HD2' ' A' ' 123' ' ' HIS . 0.4 OUTLIER -56.52 -34.19 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 CA-C-N 118.126 0.421 . . . . 0.0 111.351 177.235 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' HIS . . . . . 0.413 ' HD2' HG22 ' A' ' 122' ' ' ILE . 12.2 m170 -72.19 -31.93 66.34 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.088 -0.383 . . . . 0.0 111.39 174.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -69.53 -30.54 68.39 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.269 0.556 . . . . 0.0 110.419 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 121' ' ' GLU . 97.8 mt -72.58 10.34 0.86 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.529 -0.759 . . . . 0.0 112.202 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -51.45 -48.25 62.83 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.373 0.269 . . . . 0.0 111.456 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -70.85 109.39 4.99 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-O 120.773 0.32 . . . . 0.0 110.213 177.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 27.7 m -96.99 151.95 38.04 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.583 178.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -63.19 -25.88 72.5 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.487 2.125 . . . . 0.0 111.585 175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 63.9 t30 70.12 11.37 7.59 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.159 174.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 21.5 mmt -135.66 93.79 3.0 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.733 178.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -91.36 160.82 15.29 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.551 ' N ' HD13 ' A' ' 133' ' ' LEU . 0.0 OUTLIER -127.4 131.57 50.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.738 0.78 . . . . 0.0 111.358 -177.392 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.443 ' O ' ' HB ' ' A' ' 135' ' ' ILE . 3.1 m -134.84 116.68 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.827 -177.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . 0.443 ' HB ' ' O ' ' A' ' 134' ' ' VAL . 3.3 mp 73.93 111.12 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.037 177.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -118.27 12.43 12.64 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.898 -0.668 . . . . 0.0 111.886 178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.05 156.85 27.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.811 0.338 . . . . 0.0 110.748 178.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 97.6 t -130.63 112.57 22.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.058 -175.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -77.98 110.63 13.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 174.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -102.6 148.61 25.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.172 -177.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -141.99 137.95 31.54 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.331 177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 45.1 t . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.899 -0.572 . . . . 0.0 110.253 -178.513 . . . . . . . . 0 0 . 1 stop_ save_