data_5uke_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 5uke _Structure_validation_residue.Date_analyzed 2018-01-19 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 ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 C--O 1.22 -0.495 0 N-CA-C 111.228 0.084 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.3 m -75.02 113.5 12.42 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 20' ' ' THR . 20.5 mt -159.81 162.14 34.7 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.64 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.2 tp -63.87 -50.04 70.39 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -81.62 -35.77 29.69 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.291 0.567 . . . . 0.0 111.792 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -112.56 71.01 0.73 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.679 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.412 ' CG ' ' HZ3' ' A' ' 84' ' ' LYS . 95.5 mt -44.68 156.92 0.33 Allowed Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 124.009 0.818 . . . . 0.0 111.955 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -39.03 165.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 125.09 3.86 . . . . 0.0 114.849 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -50.06 -8.95 0.14 Allowed 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 124.061 3.174 . . . . 0.0 114.906 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.92 -36.04 67.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.68 0.218 . . . . 0.0 110.673 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.445 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.7 tp -107.82 -78.65 0.58 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.529 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -49.1 77.61 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.413 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -59.59 -51.6 58.11 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 120.405 -0.902 . . . . 0.0 114.535 -177.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.441 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.4 tm-20 -72.67 -43.77 62.68 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.35 -38.94 88.77 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.9 p -75.21 -31.95 61.05 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.032 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.27 -55.95 3.77 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.4 t -64.47 -45.21 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.03 -18.59 61.94 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.06 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.9 t70 -59.96 -38.07 81.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.987 0.422 . . . . 0.0 110.772 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -83.3 3.02 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.444 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.55 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 48.3 t -62.37 141.53 58.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.402 0.62 . . . . 0.0 112.186 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -133.33 46.37 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.642 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.56 -12.86 68.25 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.462 -0.79 . . . . 0.0 113.177 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.71 98.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.964 0.382 . . . . 0.0 111.549 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.464 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -115.29 -25.2 8.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.174 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.55 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 80.14 107.58 0.27 Allowed Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.002 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -53.32 -46.0 69.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 117.244 0.522 . . . . 0.0 111.078 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -82.97 1.69 38.54 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.872 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.32 -44.13 93.53 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.323 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -73.55 -43.77 59.1 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.182 0.491 . . . . 0.0 111.211 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.67 -39.51 93.81 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.62 -42.62 97.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.795 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.473 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 121.089 0.471 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.463 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -76.13 -21.54 56.49 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.507 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.524 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.4 mt -59.47 -42.22 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.093 0.473 . . . . 0.0 110.632 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.543 ' O ' HG11 ' A' ' 67' ' ' VAL . 16.5 mm-40 -66.51 -35.17 79.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.97 0.414 . . . . 0.0 110.946 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.463 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.8 mttt -63.02 -49.57 74.12 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -177.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.516 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 7.5 mt-10 -89.74 -2.95 58.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.543 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.5 p -54.51 -32.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 118.423 0.556 . . . . 0.0 111.432 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.12 -4.73 58.21 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.793 0.33 . . . . 0.0 111.007 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -106.48 22.47 15.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.105 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.621 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.92 19.22 12.15 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.101 -1.047 . . . . 0.0 114.131 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.621 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 96.5 142.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.337 1.055 . . . . 0.0 111.862 177.594 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.554 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.5 t -131.0 -26.42 2.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.388 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.554 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -56.58 -64.58 4.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.095 -1.05 . . . . 0.0 111.892 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.7 m -88.32 -38.48 15.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 111.694 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.37 -47.75 84.71 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -177.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.5 tt0 -63.21 -40.35 97.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.758 0.313 . . . . 0.0 110.866 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.1 -46.45 90.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.65 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.2 mt -70.5 -38.58 74.34 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -75.7 -6.73 51.94 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.685 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.8 m -58.65 -40.13 82.57 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -86.26 -89.57 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.788 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.59 -86.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -114.13 -54.83 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.445 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 20.9 ttpp -132.66 -44.2 0.9 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.437 175.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.7 t30 47.76 35.78 5.04 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.753 0.821 . . . . 0.0 111.815 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.25 171.08 14.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.921 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -121.21 157.96 29.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.73 -39.09 78.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.69 -39.72 98.28 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.774 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.35 -45.52 90.82 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.54 -23.98 45.91 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.393 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.6 tp -59.36 -40.64 87.1 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.673 0.273 . . . . 0.0 110.724 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -62.24 -41.53 98.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.299 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -69.56 -41.11 80.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.0 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 4.2 mp -59.84 -41.12 90.68 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.826 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.61 -40.51 97.09 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.073 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.78 -46.18 89.21 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.823 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.3 mmm -70.09 -37.34 75.38 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.775 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.48 38.51 5.28 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.383 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.464 ' NE2' ' HB3' ' A' ' 44' ' ' LEU . 39.4 m170 -79.98 91.71 5.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.928 0.394 . . . . 0.0 110.631 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -62.9 -42.08 99.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.9 tpt85 -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 110.647 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.24 -38.91 88.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.731 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.604 ' O ' HG22 ' A' ' 107' ' ' ILE . 45.1 mm -62.78 -39.56 85.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.863 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -60.25 -48.0 83.61 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.222 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.441 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -80.71 -22.04 40.68 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -178.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 104' ' ' ILE . 3.1 tp -60.66 -20.66 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 120.871 0.367 . . . . 0.0 111.424 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -71.94 -12.22 61.15 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.609 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.25 -27.18 65.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.189 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.8 t80 . . . . . 0 CA--C 1.532 0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.891 179.582 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.217 -0.615 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.6 m -71.24 116.07 11.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.654 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.41 162.44 17.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.312 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -64.84 -50.46 66.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.02 -35.81 23.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.412 0.625 . . . . 0.0 111.408 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -110.11 70.67 0.73 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.146 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.9 mt -46.35 156.18 0.51 Allowed Pre-proline 0 N--CA 1.467 0.405 0 O-C-N 124.067 0.854 . . . . 0.0 111.69 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -38.83 165.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 124.98 3.787 . . . . 0.0 114.698 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.91 -8.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.2 3.266 . . . . 0.0 115.204 -178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.3 -36.64 66.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.975 0.352 . . . . 0.0 110.39 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.5 tp -106.65 -78.33 0.58 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.5 -51.7 68.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -178.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.57 -51.26 60.13 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.639 -0.791 . . . . 0.0 114.826 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.49 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.3 tm-20 -70.88 -43.62 68.0 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.08 -38.8 86.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.3 p -72.19 -31.07 65.57 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.62 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.62 -55.49 3.96 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.53 -45.69 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -73.11 -19.16 61.2 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.377 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.7 t70 -60.11 -39.16 85.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.012 0.434 . . . . 0.0 111.098 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.9 m -90.22 9.12 29.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.971 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 t -68.02 143.82 55.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.205 0.526 . . . . 0.0 111.695 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.32 49.51 2.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.217 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.69 -12.57 69.21 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.561 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.71 98.73 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.16 0.505 . . . . 0.0 111.136 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.4 mt -119.44 -26.63 5.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.722 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.92 113.51 0.32 Allowed Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.894 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 9.6 p90 -53.29 -47.44 69.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.009 0.404 . . . . 0.0 110.473 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -84.29 1.11 46.39 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.917 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.69 -46.7 91.9 Favored Glycine 0 CA--C 1.517 0.199 0 C-N-CA 120.159 -1.02 . . . . 0.0 113.334 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.18 -42.61 59.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.017 0.408 . . . . 0.0 110.911 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.6 -40.43 96.91 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.37 -45.81 92.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.237 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 . . . . . 0 N--CA 1.462 0.144 0 CA-C-O 120.842 0.353 . . . . 0.0 111.234 179.034 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.463 0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -74.69 -25.08 58.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.962 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.514 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.7 mt -59.88 -43.4 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 110.161 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.603 ' O ' HG11 ' A' ' 67' ' ' VAL . 99.1 mt-10 -66.99 -36.01 81.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.69 -49.08 76.52 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -90.18 -3.78 57.66 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.603 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.6 p -56.05 -34.41 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.271 0.487 . . . . 0.0 111.321 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.2 -4.21 58.31 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 110.813 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -105.67 21.93 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.751 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.04 21.42 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.362 -0.923 . . . . 0.0 114.276 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 94.91 141.56 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.319 1.047 . . . . 0.0 112.159 177.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.521 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.8 t -131.56 -29.89 1.71 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.42 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -53.02 -66.98 2.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.356 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.9 m -87.38 -36.71 17.62 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 122.625 -0.338 . . . . 0.0 111.525 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -60.77 -47.16 87.58 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.521 ' HB3' ' O ' ' A' ' 72' ' ' SER . 81.7 tt0 -62.11 -42.4 99.19 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.17 -45.62 90.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.291 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.6 -40.21 84.77 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.843 0.354 . . . . 0.0 111.285 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -81.5 -5.85 58.37 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.6 t -58.99 -41.35 87.44 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.9 m95 -85.4 -89.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.796 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.53 -87.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -114.47 -54.29 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.414 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 16.0 ttpp -132.3 -43.51 0.94 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.4 t30 48.25 34.19 4.31 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.791 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.51 170.83 15.2 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.789 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 63.2 p -126.45 159.13 34.21 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.375 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.7 mp -59.7 -40.03 81.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.407 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.0 -39.49 97.14 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.546 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -63.82 -44.23 93.85 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.461 ' O ' HG22 ' A' ' 94' ' ' VAL . 0.8 OUTLIER -73.85 -27.58 61.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.736 -179.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.6 mt -60.28 -32.83 71.56 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.542 0.21 . . . . 0.0 111.442 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -61.03 -42.52 98.63 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.479 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 91' ' ' LEU . 15.7 m -86.3 -23.21 6.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.411 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 91' ' ' LEU . 1.8 mp -61.9 -43.25 99.24 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.833 0.349 . . . . 0.0 110.255 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -65.72 -39.95 91.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.739 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -64.21 -43.84 93.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.03 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -71.75 -39.13 70.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.595 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.24 33.36 6.0 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.551 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.562 ' CG ' ' HB3' ' A' ' 103' ' ' ALA . 2.3 t-80 -75.92 86.28 2.86 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.065 0.459 . . . . 0.0 111.35 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.84 -41.21 95.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.549 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.24 -39.86 94.82 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.487 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.562 ' HB3' ' CG ' ' A' ' 100' ' ' HIS . . . -60.71 -38.81 86.3 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.731 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.586 ' O ' HG21 ' A' ' 107' ' ' ILE . 97.1 mt -61.47 -43.67 97.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.278 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -61.48 -47.66 84.67 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.245 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.49 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -77.88 -22.46 49.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -179.149 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.586 HG21 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -63.32 -19.99 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.773 0.321 . . . . 0.0 111.478 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.2 p -67.84 -12.84 61.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.429 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -69.83 -27.45 64.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.52 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 . . . . . 0 C--O 1.233 0.193 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 179.316 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 . . . . . 0 C--O 1.222 -0.393 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t -74.43 125.37 28.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -178.44 4.99 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.492 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.05 -58.23 3.26 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -73.92 -35.73 64.64 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.554 0.692 . . . . 0.0 110.513 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -109.91 70.28 0.72 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.732 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -48.34 156.38 0.81 Allowed Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.987 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -34.93 163.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 125.086 3.857 . . . . 0.0 115.17 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.41 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 82.1 Cg_exo -49.24 -8.72 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 124.277 3.318 . . . . 0.0 115.054 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.62 -35.56 63.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.605 0.184 . . . . 0.0 110.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.6 tp -108.64 -79.19 0.58 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.3 tp -62.01 -47.75 83.37 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -60.63 -51.3 59.56 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.651 -0.785 . . . . 0.0 114.632 -177.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -70.5 -43.52 69.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.71 -38.44 86.74 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.967 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.8 p -73.25 -31.82 64.34 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.797 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.34 -54.49 4.56 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -178.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 71.5 t -64.54 -43.99 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.8 mt -71.09 -18.25 62.55 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.419 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 5.7 t70 -59.58 -37.81 79.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 0.0 110.661 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.1 m -86.75 7.39 26.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.527 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.9 t -65.54 140.01 58.52 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.345 0.593 . . . . 0.0 111.746 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -131.42 44.06 2.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.454 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.59 -10.91 72.21 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.392 -0.822 . . . . 0.0 113.017 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.19 97.71 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.905 0.352 . . . . 0.0 111.562 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -116.24 -22.19 8.98 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.527 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.53 113.72 0.25 Allowed Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.764 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -52.37 -49.2 64.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.284 0.542 . . . . 0.0 109.925 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -83.93 1.38 43.73 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.562 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.62 92.33 Favored Glycine 0 CA--C 1.516 0.129 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.437 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.7 -43.32 59.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 0.0 111.223 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.53 -39.9 94.63 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -59.69 -45.05 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.383 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 . . . . . 0 N--CA 1.463 0.223 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.745 179.445 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -68.84 -26.36 65.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.023 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.636 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.9 mt -59.67 -38.99 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.183 0.516 . . . . 0.0 110.455 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.554 ' O ' HG11 ' A' ' 67' ' ' VAL . 80.4 mm-40 -79.66 -21.24 45.01 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.106 -0.371 . . . . 0.0 111.193 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.17 -45.41 60.53 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.605 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.3 mt-10 -87.97 -4.72 58.78 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.554 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.8 p -58.56 -28.55 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.236 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -74.73 -14.75 60.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -95.66 9.06 41.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.917 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 71' ' ' LYS . . . 104.22 -7.2 47.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 118.33 -1.261 . . . . 0.0 114.866 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 2.0 tppt? 158.58 139.1 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.263 1.032 . . . . 0.0 112.088 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.636 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.0 t -134.27 -24.17 1.64 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.46 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.485 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -57.23 -67.43 2.22 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.97 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.3 m -88.62 -35.12 17.03 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.569 -0.371 . . . . 0.0 111.482 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.456 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 74.0 ttt180 -60.75 -46.35 90.78 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.731 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' A' ' 72' ' ' SER . 80.7 tt0 -60.54 -44.27 96.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 110.52 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.1 tp -62.54 -47.82 82.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.253 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.446 HD21 ' HD2' ' A' ' 86' ' ' LYS . 85.3 mt -65.16 -39.81 93.45 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.53 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -81.0 -5.75 57.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.8 m -59.34 -39.84 84.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 65.8 m95 -86.27 -89.97 0.11 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.278 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.82 -87.07 0.49 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.134 0.492 . . . . 0.0 110.053 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -112.62 -56.75 2.37 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' A' ' 86' ' ' LYS . 13.6 ttpp -131.95 -43.57 0.98 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.564 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.6 t30 49.73 28.93 2.89 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.975 -1.012 . . . . 0.0 112.91 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.508 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 37.8 mttp -135.51 134.17 39.22 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 44.5 p -83.82 161.19 21.01 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.61 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.06 -40.33 82.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.143 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.36 -40.21 98.66 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.49 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -63.46 -48.59 77.08 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.562 ' O ' HD13 ' A' ' 95' ' ' LEU . 0.1 OUTLIER -75.98 -24.11 55.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.862 -179.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.82 -39.38 81.01 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.425 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.88 -41.16 95.43 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.868 0.366 . . . . 0.0 110.452 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.7 -40.71 84.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 121.224 0.535 . . . . 0.0 109.729 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.562 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -60.31 -39.92 88.72 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.613 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.39 -40.02 96.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.812 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -63.94 -41.67 97.55 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.731 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.0 tpt -70.05 -38.84 75.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.086 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.29 29.77 11.92 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.721 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.22 99.47 4.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.924 0.392 . . . . 0.0 111.06 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.58 -41.83 96.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.669 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -62.31 -41.39 98.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.125 0.488 . . . . 0.0 110.805 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.89 -39.88 90.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.701 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.552 ' O ' HG22 ' A' ' 107' ' ' ILE . 42.0 mm -62.66 -45.21 99.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -66.51 -40.76 89.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.3 tp -83.89 -21.79 31.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.552 HG22 ' O ' ' A' ' 104' ' ' ILE . 10.2 tt -65.79 -20.22 26.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.927 0.394 . . . . 0.0 111.321 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.0 p -70.05 -9.93 57.0 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.814 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.41 -17.62 63.02 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 89.7 t80 . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 120.779 0.323 . . . . 0.0 110.352 179.204 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.5 m80 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.9 t -81.64 113.58 19.75 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.453 HD11 ' OD2' ' A' ' 24' ' ' ASP . 24.7 mt -153.36 167.09 30.57 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.836 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.13 -50.19 71.42 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -81.8 -35.58 29.36 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.493 0.663 . . . . 0.0 111.348 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.453 ' OD2' HD11 ' A' ' 21' ' ' LEU . 1.8 p-10 -112.42 71.85 0.76 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.009 179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.435 HD12 ' CE1' ' A' ' 110' ' ' TYR . 91.6 mt -44.53 155.45 0.37 Allowed Pre-proline 0 CA--C 1.538 0.515 0 O-C-N 123.978 0.798 . . . . 0.0 111.22 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -38.69 165.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 124.846 3.697 . . . . 0.0 114.794 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -49.05 -8.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 124.01 3.14 . . . . 0.0 114.99 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.76 -35.79 64.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.741 0.246 . . . . 0.0 110.657 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 tp -108.38 -78.64 0.59 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.4 tp -61.39 -48.65 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -51.1 60.73 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.595 -0.812 . . . . 0.0 114.494 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -70.79 -43.0 69.59 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.9 -38.68 86.73 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.842 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -73.25 -30.52 63.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.656 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.81 -55.45 3.96 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.72 -45.64 96.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.62 -21.01 61.9 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.12 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.646 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.8 t0 -61.55 -38.65 88.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.039 0.447 . . . . 0.0 110.503 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.4 p -85.2 1.54 47.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.107 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.553 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.6 t -64.22 141.33 58.81 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.297 0.57 . . . . 0.0 111.663 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.91 39.04 3.85 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.926 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.18 -16.73 57.89 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.06 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.06 99.34 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.971 0.415 . . . . 0.0 111.816 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.423 ' O ' ' HE2' ' A' ' 98' ' ' MET . 81.8 mt -108.89 -21.56 12.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.183 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.553 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 76.11 107.05 0.12 Allowed Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.563 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.2 p90 -52.88 -50.81 63.12 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 117.313 0.557 . . . . 0.0 110.349 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.77 -0.04 52.37 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.095 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.42 95.57 Favored Glycine 0 C--O 1.23 -0.115 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.023 -177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -81.79 -42.4 19.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.735 0.303 . . . . 0.0 111.215 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.45 -41.73 96.37 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -61.48 -41.26 96.98 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.115 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 120.76 0.314 . . . . 0.0 111.203 179.176 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 CA--C 1.529 0.163 0 CA-C-O 120.637 0.256 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -72.66 -29.5 63.49 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.216 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.541 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.7 mt -60.23 -43.11 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.615 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.1 mm-40 -67.64 -35.93 79.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.238 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.2 -48.61 79.24 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.522 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -89.95 -3.47 58.01 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.615 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -55.85 -34.04 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 118.202 0.455 . . . . 0.0 111.432 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.22 -4.77 58.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.935 0.397 . . . . 0.0 110.853 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.48 21.81 16.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.818 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.584 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.13 21.22 9.65 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.311 -0.947 . . . . 0.0 114.22 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.584 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 94.18 141.77 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.281 1.032 . . . . 0.0 112.248 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.548 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 4.1 t -129.99 -30.38 2.01 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.998 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.35 -66.07 3.05 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.022 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.44 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.02 -35.6 18.69 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.4 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.7 ttt180 -62.69 -47.22 84.6 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.548 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -62.34 -41.33 98.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.615 0.245 . . . . 0.0 111.152 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.07 -47.22 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.979 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.46 -39.4 70.98 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.069 0.462 . . . . 0.0 111.673 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -76.62 -7.26 54.9 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -58.43 -38.59 77.75 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -87.58 -90.57 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.676 -0.409 . . . . 0.0 110.928 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.405 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . . . -108.44 -86.81 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 82' ' ' ALA . 22.1 mp0 -110.96 -56.89 2.31 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -132.62 -43.49 0.91 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.419 176.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.4 36.21 6.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.718 0.807 . . . . 0.0 111.788 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.99 171.05 14.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.485 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -121.21 157.4 30.34 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.324 179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -39.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.374 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.97 -39.45 98.08 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.862 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -63.23 -45.67 90.53 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.571 ' O ' HD13 ' A' ' 95' ' ' LEU . 0.2 OUTLIER -77.49 -24.6 50.1 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.658 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.8 tp -58.97 -41.74 88.24 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.176 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.94 -41.81 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.087 0.47 . . . . 0.0 110.471 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.0 t -68.3 -42.06 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.431 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.571 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.0 mp -60.28 -40.17 89.47 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.004 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.1 -39.21 93.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.495 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -62.61 -45.33 93.34 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.476 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.423 ' HE2' ' O ' ' A' ' 44' ' ' LEU . 14.5 tpt -72.61 -39.41 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.257 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.37 39.55 3.44 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.472 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.49 ' ND1' ' HB3' ' A' ' 103' ' ' ALA . 13.3 t-160 -80.47 95.23 6.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.177 0.513 . . . . 0.0 110.546 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.89 -42.3 94.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -62.77 -39.38 94.0 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.855 0.36 . . . . 0.0 111.695 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.49 ' HB3' ' ND1' ' A' ' 100' ' ' HIS . . . -60.54 -38.7 85.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.279 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.446 ' O ' HG21 ' A' ' 107' ' ' ILE . 95.9 mt -60.93 -43.27 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.035 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -62.96 -42.08 99.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.03 -31.13 25.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.446 HG21 ' O ' ' A' ' 104' ' ' ILE . 9.0 tt -62.3 -24.49 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.18 0.514 . . . . 0.0 110.47 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.407 ' O ' HG23 ' A' ' 108' ' ' THR . 85.1 m -64.88 -26.13 68.19 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.076 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -67.92 -20.44 65.09 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.435 ' CE1' HD12 ' A' ' 25' ' ' LEU . 81.0 t80 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.22 -0.452 0 N-CA-C 111.264 0.098 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -72.61 115.08 11.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.794 0.33 . . . . 0.0 111.886 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 24' ' ' ASP . 23.8 tp -152.85 163.24 40.12 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.94 -47.63 85.54 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -90.87 -35.83 14.54 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.425 0.631 . . . . 0.0 110.555 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.519 ' HB2' ' HB2' ' A' ' 83' ' ' GLN . 49.2 t0 -94.03 74.91 4.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.737 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.4 HD12 ' CE1' ' A' ' 110' ' ' TYR . 82.5 mt -47.37 154.21 0.86 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.357 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -38.61 166.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 124.82 3.68 . . . . 0.0 114.894 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.78 -9.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 124.312 3.341 . . . . 0.0 115.545 -178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.04 -34.82 63.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.087 0.403 . . . . 0.0 109.987 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.441 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.6 tp -107.79 -77.88 0.59 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.7 -52.03 65.95 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.44 -50.57 66.32 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.343 -0.932 . . . . 0.0 114.82 -177.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' OE2' HG21 ' A' ' 36' ' ' VAL . 43.2 tp10 -68.84 -43.74 74.87 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 97.1 mt -68.23 -39.19 82.4 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 120.69 -0.404 . . . . 0.0 112.054 -179.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.669 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.0 p -71.6 -27.99 63.5 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.357 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.72 -57.54 3.01 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.486 HG21 ' OE2' ' A' ' 32' ' ' GLU . 55.6 t -64.36 -45.26 96.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.419 HD22 ' NE2' ' A' ' 100' ' ' HIS . 97.6 mt -70.69 -22.49 62.46 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.669 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.6 t0 -61.11 -36.5 79.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.981 0.42 . . . . 0.0 110.872 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.3 m -88.06 11.45 16.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.119 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.504 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 46.2 t -62.16 143.24 57.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.564 0.697 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -131.9 36.97 3.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.393 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.64 -13.96 66.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.925 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.84 96.29 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.56 -25.5 9.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.11 0.481 . . . . 0.0 110.561 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.504 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 77.22 109.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.184 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.1 p90 -52.7 -49.85 64.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.377 0.588 . . . . 0.0 110.625 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -83.91 -0.38 51.15 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.485 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.43 -45.96 93.7 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.704 -177.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.6 mt -74.86 -44.14 50.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.213 0.53 . . . . 0.0 111.17 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -39.91 94.5 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.0 tp10 -59.23 -44.45 92.31 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.522 0.514 . . . . 0.0 111.371 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 mtt85 . . . . . 0 C--N 1.333 -0.136 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.708 179.247 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.922 0.391 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -77.17 -22.33 52.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.174 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.585 ' O ' HG12 ' A' ' 67' ' ' VAL . 78.9 mt -60.2 -42.62 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.9 0.381 . . . . 0.0 110.835 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.527 ' O ' HG23 ' A' ' 67' ' ' VAL . 80.3 mm-40 -71.48 -20.99 62.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.531 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -72.11 -46.66 55.8 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.593 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 67.3 mm-40 -89.78 -2.98 58.37 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -177.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 63' ' ' ILE . 16.2 m -55.43 -32.22 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.95 0.795 . . . . 0.0 111.942 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -88.44 -5.63 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.471 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -107.97 18.21 21.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.602 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.51 23.5 7.92 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.113 -1.042 . . . . 0.0 114.934 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.602 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 95.3 143.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.249 1.02 . . . . 0.0 112.559 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.1 t -132.64 -32.13 1.31 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.301 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.31 -67.39 1.99 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.697 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.2 m -86.89 -36.35 18.46 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.652 0.263 . . . . 0.0 111.283 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.98 -47.98 83.94 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.4 tt0 -61.42 -43.18 99.32 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.575 0.226 . . . . 0.0 111.26 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.31 -45.46 93.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.115 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.4 -38.72 78.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.853 0.359 . . . . 0.0 111.356 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 22.5 m95 -77.31 -5.87 51.12 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.7 m -59.1 -39.67 82.95 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -86.12 -89.95 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.987 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.39 -87.52 0.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 97.7 mm-40 -111.8 -53.95 2.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 24' ' ' ASP . 23.5 ttpp -133.14 -43.88 0.86 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.938 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.8 t30 48.59 37.99 10.35 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.137 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 171.96 13.52 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.9 p -120.69 156.14 32.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.428 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.54 -38.62 78.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.106 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.58 -39.76 98.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.751 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.3 -45.73 90.03 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.49 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 0.2 OUTLIER -77.18 -24.72 51.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.382 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.83 -41.65 91.79 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.851 0.358 . . . . 0.0 110.85 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -62.55 -40.42 96.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.093 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.8 t -68.1 -40.07 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.11 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 91.5 mt -61.09 -39.22 89.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.451 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -62.77 -39.33 93.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.568 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -62.37 -39.87 94.6 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.698 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -12.12 41.03 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.75 39.88 59.26 Favored Glycine 0 C--N 1.329 0.157 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.725 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.486 ' ND1' ' HB1' ' A' ' 103' ' ' ALA . 10.5 t-80 -70.75 93.43 0.95 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.113 0.483 . . . . 0.0 110.608 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.633 ' O ' HG23 ' A' ' 104' ' ' ILE . 82.9 mtt85 -64.5 -42.25 95.94 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -66.59 -39.43 88.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.486 ' HB1' ' ND1' ' A' ' 100' ' ' HIS . . . -60.78 -39.07 87.49 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.633 HG23 ' O ' ' A' ' 101' ' ' ARG . 8.5 tp -62.83 -31.87 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.44 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -70.57 -41.2 72.72 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.71 0.29 . . . . 0.0 111.228 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.29 -22.19 30.79 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.516 HG23 ' O ' ' A' ' 104' ' ' ILE . 2.8 tp -62.03 -20.49 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 120.93 0.395 . . . . 0.0 111.231 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.4 p -70.39 -12.54 61.65 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.663 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.87 -26.8 64.36 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.76 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.4 ' CE1' HD12 ' A' ' 25' ' ' LEU . 78.1 t80 . . . . . 0 CA--C 1.531 0.247 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.244 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 . . . . . 0 C--O 1.224 -0.237 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 t -78.77 130.87 36.23 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -176.84 2.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.012 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mp -79.88 -57.62 3.56 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -72.92 -35.35 67.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.584 0.707 . . . . 0.0 110.7 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.27 71.1 0.73 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.165 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.428 HD11 ' CE1' ' A' ' 110' ' ' TYR . 95.4 mt -49.34 157.1 0.94 Allowed Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.077 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -37.28 163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 124.478 3.452 . . . . 0.0 115.009 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.404 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 88.7 Cg_exo -49.52 -9.09 0.12 Allowed 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 124.146 3.23 . . . . 0.0 114.95 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' CB ' ' HA ' ' A' ' 107' ' ' ILE . . . -55.19 -36.38 65.83 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 121.98 0.112 . . . . 0.0 110.995 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.419 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.02 -78.12 0.59 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.87 -47.6 84.25 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -60.79 -52.92 49.39 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.333 -0.937 . . . . 0.0 114.73 -177.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.94 -43.88 64.5 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.89 -39.44 87.46 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.3 p -73.97 -30.83 62.71 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 120.121 -0.632 . . . . 0.0 111.838 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.4 -56.32 3.58 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.64 -45.22 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -177.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.409 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 83.9 mt -74.51 -17.34 60.77 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.165 -0.334 . . . . 0.0 111.42 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.481 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 7.3 t70 -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.028 0.442 . . . . 0.0 110.976 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 59.1 m -88.85 10.79 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.53 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.0 t -67.49 145.2 55.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.087 0.47 . . . . 0.0 111.199 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.95 50.75 2.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.72 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.96 -12.73 69.32 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.9 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.58 98.79 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 117.285 0.542 . . . . 0.0 110.992 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -120.52 -30.49 4.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.329 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.31 118.08 1.04 Allowed Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.544 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.4 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 6.4 p90 -56.0 -43.03 77.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.057 0.428 . . . . 0.0 110.348 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.0 ptt180 -83.66 0.44 46.93 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.419 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.3 -50.2 63.77 Favored Glycine 0 CA--C 1.516 0.148 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.914 -177.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -71.99 -42.0 66.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.288 0.544 . . . . 0.0 111.496 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -65.58 -42.71 91.45 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.33 -45.76 92.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.286 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.405 ' NH2' ' HG2' ' A' ' 97' ' ' GLU . 99.7 mtt180 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.716 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 120.762 0.315 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.46 -28.15 61.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.559 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.497 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.8 mt -60.1 -44.05 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.331 0.586 . . . . 0.0 110.03 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.598 ' O ' HG13 ' A' ' 67' ' ' VAL . 98.7 mt-10 -66.78 -37.09 83.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.249 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.96 -46.71 86.44 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.0 mt-10 -89.78 -4.28 57.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.598 HG13 ' O ' ' A' ' 64' ' ' GLU . 5.4 p -56.87 -33.31 41.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 118.361 0.528 . . . . 0.0 111.141 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.87 -4.36 58.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.931 0.396 . . . . 0.0 110.842 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -106.58 21.61 17.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.84 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.638 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.94 21.56 9.5 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.233 -0.984 . . . . 0.0 114.282 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.638 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.1 OUTLIER 95.24 147.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.602 1.161 . . . . 0.0 111.667 177.687 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.521 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.3 t -134.8 -36.57 0.84 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.401 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -50.22 -66.0 2.61 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.486 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 20.6 m -86.18 -37.51 18.63 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 122.352 -0.499 . . . . 0.0 111.273 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -60.95 -47.17 87.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.471 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.1 tt0 -62.32 -42.17 99.15 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.626 0.25 . . . . 0.0 110.817 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.2 tp -61.32 -46.24 91.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.5 mt -70.06 -39.13 75.86 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.432 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -79.57 -4.88 53.52 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.2 m -58.37 -39.77 80.47 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -86.37 -90.01 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.959 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.96 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.3 0.571 . . . . 0.0 109.724 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -111.88 -57.11 2.31 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 19.0 ttpp -132.24 -43.45 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.184 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.24 34.72 4.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.816 0.847 . . . . 0.0 111.647 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.89 15.11 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.6 p -122.57 158.72 29.29 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.336 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.39 -40.82 82.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.144 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.86 98.26 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.719 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.67 -45.86 88.19 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.78 -24.5 52.89 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 96' ' ' GLN . 60.5 tp -60.03 -40.8 90.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.409 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.41 -43.21 99.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.937 0.399 . . . . 0.0 110.791 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.3 -40.05 77.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 121.618 0.723 . . . . 0.0 109.65 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.417 HD13 ' CB ' ' A' ' 103' ' ' ALA . 50.1 tp -60.85 -40.47 93.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.26 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 92' ' ' LEU . 96.5 mt-30 -61.66 -38.88 89.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.405 ' HG2' ' NH2' ' A' ' 52' ' ' ARG . 86.3 tt0 -62.66 -42.4 99.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 52.2 tpp -70.61 -40.0 73.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.379 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 81.75 40.09 11.2 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.578 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.62 ' ND1' ' HB1' ' A' ' 103' ' ' ALA . 20.7 t-160 -75.84 111.79 11.56 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.373 0.606 . . . . 0.0 110.73 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.32 -43.04 92.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.537 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.4 tpp180 -69.74 -38.72 76.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.62 ' HB1' ' ND1' ' A' ' 100' ' ' HIS . . . -60.11 -42.04 93.86 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.494 ' O ' HG22 ' A' ' 107' ' ' ILE . 46.8 pt -70.66 -27.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.868 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.82 -49.91 70.99 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.214 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.415 HD12 ' ND2' ' A' ' 109' ' ' ASN . 12.3 tp -83.92 -22.92 31.39 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.494 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.2 tt -61.84 -21.75 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.107 0.48 . . . . 0.0 111.148 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 54.3 m -62.17 -25.32 67.7 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.399 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . 0.415 ' ND2' HD12 ' A' ' 106' ' ' LEU . 97.7 m-20 -70.33 -14.15 62.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.428 ' CE1' HD11 ' A' ' 25' ' ' LEU . 72.0 t80 . . . . . 0 N--CA 1.463 0.206 0 CA-C-O 120.755 0.312 . . . . 0.0 110.587 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.3 m80 . . . . . 0 C--O 1.217 -0.64 0 N-CA-C 111.295 0.109 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -70.67 119.72 15.24 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.36 161.67 12.1 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.071 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.03 -50.5 66.0 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -81.24 -35.65 30.95 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.43 0.633 . . . . 0.0 111.341 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.52 70.77 0.72 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.627 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.422 ' CG ' ' HZ2' ' A' ' 84' ' ' LYS . 91.3 mt -46.11 156.28 0.48 Allowed Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 123.904 0.753 . . . . 0.0 111.372 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -38.43 165.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 124.91 3.74 . . . . 0.0 114.725 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -49.33 -9.35 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.041 3.16 . . . . 0.0 114.996 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.421 ' CB ' ' HA ' ' A' ' 107' ' ' ILE . . . -54.48 -35.9 63.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.374 0.13 . . . . 0.0 110.734 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.404 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.74 -78.8 0.59 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.42 -48.02 83.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.76 -51.52 58.14 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.654 -0.784 . . . . 0.0 114.467 -177.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.437 ' OE2' HG22 ' A' ' 36' ' ' VAL . 37.4 tp10 -70.57 -43.39 69.56 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.63 -39.34 88.24 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -71.78 -30.34 65.45 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 120.55 -0.46 . . . . 0.0 111.712 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.23 -56.75 3.38 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.437 HG22 ' OE2' ' A' ' 32' ' ' GLU . 54.3 t -64.26 -44.51 97.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.07 -19.15 61.86 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.351 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.494 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.0 t70 -59.75 -38.91 83.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 110.747 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.9 m -88.71 6.3 39.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.989 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.436 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 46.0 t -65.69 141.48 58.35 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.256 0.55 . . . . 0.0 111.536 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -132.68 50.68 2.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.252 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.98 -11.64 71.65 Favored Glycine 0 CA--C 1.52 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 113.49 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.8 98.52 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 117.253 0.527 . . . . 0.0 111.066 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -119.94 -23.31 6.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.909 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.436 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 78.47 111.69 0.2 Allowed Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.285 -179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.472 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 21.3 p90 -54.08 -44.4 71.14 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.235 0.518 . . . . 0.0 110.88 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.467 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 0.0 OUTLIER -84.71 -0.08 52.32 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.781 178.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.96 -45.38 95.23 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.446 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.0 mt -71.55 -42.92 67.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.847 0.323 . . . . 0.0 111.163 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 73' ' ' GLY . . . -65.34 -43.26 91.48 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.41 -40.08 95.35 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.694 -178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.781 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.982 0.42 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.428 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 12.7 t60 -73.89 -25.97 60.29 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.287 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.498 ' O ' ' HB3' ' A' ' 72' ' ' SER . 81.2 mt -59.4 -42.25 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.068 0.461 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.539 ' O ' HG13 ' A' ' 67' ' ' VAL . 16.5 mm-40 -69.51 -27.44 65.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.029 179.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -70.26 -50.07 43.38 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.322 1.231 . . . . 0.0 114.322 -178.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.2 mt-10 -89.53 -3.56 58.28 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.539 HG13 ' O ' ' A' ' 64' ' ' GLU . 9.7 p -55.54 -34.62 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 118.158 0.435 . . . . 0.0 111.308 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.17 -4.12 58.36 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.942 0.401 . . . . 0.0 110.76 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -105.68 21.88 16.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.796 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.14 22.26 8.88 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.266 -0.969 . . . . 0.0 114.363 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 94.18 140.16 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.251 1.02 . . . . 0.0 112.212 177.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.9 t -131.87 -25.82 2.03 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.483 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.579 ' O ' ' HB1' ' A' ' 50' ' ' ALA . . . -57.01 -66.19 3.03 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.023 -1.084 . . . . 0.0 112.11 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.405 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 21.4 m -87.58 -36.63 17.43 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.37 -47.95 83.86 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.744 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.562 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.3 tt0 -63.04 -40.61 98.24 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.868 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.15 -46.16 91.68 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.3 mt -68.74 -39.37 80.36 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -78.07 -5.64 52.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.3 m -58.92 -39.74 82.46 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -85.99 -89.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.42 -86.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -114.68 -54.01 2.61 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.436 ' HG2' ' H ' ' A' ' 86' ' ' LYS . 20.3 ttpp -132.62 -44.9 0.89 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.8 t30 47.87 32.17 2.63 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.221 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.38 132.57 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -81.95 160.45 23.35 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.65 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.31 -38.94 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.122 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.99 -39.04 97.59 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.726 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.32 -46.26 89.52 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.55 -24.38 45.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 61.4 tp -59.45 -40.53 87.16 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.627 0.251 . . . . 0.0 111.077 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -62.29 -41.3 98.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.559 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.63 -40.19 79.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.032 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.31 -36.95 76.55 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.241 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 92' ' ' LEU . 99.0 mm-40 -62.97 -39.9 96.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.287 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -62.57 -46.08 89.98 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.789 0.328 . . . . 0.0 110.718 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.1 mmt -70.36 -36.59 74.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.15 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.463 ' O ' ' HD3' ' A' ' 101' ' ' ARG . . . 93.53 40.61 4.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.245 -0.979 . . . . 0.0 111.983 -179.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.511 ' CG ' ' HB2' ' A' ' 103' ' ' ALA . 2.1 t-80 -76.89 86.95 3.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.317 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.463 ' HD3' ' O ' ' A' ' 99' ' ' GLY . 1.4 mpp_? -63.18 -43.35 98.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.529 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -63.32 -39.9 95.85 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.688 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.511 ' HB2' ' CG ' ' A' ' 100' ' ' HIS . . . -60.87 -37.79 83.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.552 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.3 mt -60.21 -43.18 92.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.615 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -63.93 -43.21 96.59 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.44 -23.05 30.13 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.552 HG22 ' O ' ' A' ' 104' ' ' ILE . 9.7 tt -64.74 -20.96 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.845 0.355 . . . . 0.0 111.632 -179.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 79.7 p -69.08 -16.7 63.74 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.448 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -71.73 -14.65 62.08 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.576 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 63.8 t80 . . . . . 0 CA--C 1.531 0.212 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.287 179.499 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.218 -0.565 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.8 m -75.61 117.44 17.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.652 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.9 169.21 21.63 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.735 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -64.18 -50.52 67.79 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.406 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . 99.7 m-85 -91.92 -35.68 13.88 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.277 0.56 . . . . 0.0 111.133 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.9 70.76 1.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.307 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.0 mt -47.43 156.32 0.64 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.642 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.55 166.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.257 3.972 . . . . 0.0 114.977 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.89 -8.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.232 0 C-N-CA 124.112 3.208 . . . . 0.0 115.312 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.7 -36.55 67.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 118.025 0.375 . . . . 0.0 110.219 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.451 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.66 -78.37 0.59 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.9 tp -61.11 -48.72 80.35 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.44 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -61.07 -51.26 59.54 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 120.473 -0.87 . . . . 0.0 114.343 -177.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.457 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.39 -43.28 70.37 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.22 -37.89 84.35 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.61 -0.436 . . . . 0.0 112.085 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.609 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.7 p -75.28 -31.7 60.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.774 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.97 -56.89 3.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.49 -44.77 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.55 HD23 ' NE2' ' A' ' 100' ' ' HIS . 70.5 mt -72.84 -19.42 61.31 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.187 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.609 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 39.6 t0 -62.02 -36.19 80.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.168 0.508 . . . . 0.0 110.158 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.8 m -88.1 7.41 31.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.996 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.518 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.7 t -62.76 142.77 58.02 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.411 0.624 . . . . 0.0 111.717 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -130.35 40.0 3.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.849 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.15 -11.96 69.81 Favored Glycine 0 CA--C 1.519 0.3 0 CA-C-N 115.456 -0.793 . . . . 0.0 113.094 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.77 -42.88 97.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.967 0.383 . . . . 0.0 111.654 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.0 mt -113.8 -22.06 10.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.078 0.466 . . . . 0.0 110.5 179.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.518 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 77.9 109.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.705 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.4 p90 -52.12 -52.38 51.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 117.107 0.454 . . . . 0.0 110.641 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -83.55 0.64 45.7 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.752 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.74 -47.08 91.03 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.158 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.7 mt -73.38 -43.19 61.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.96 0.38 . . . . 0.0 111.376 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.72 -40.73 95.82 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -60.68 -43.74 97.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.243 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 . . . . . 0 C--O 1.232 0.145 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.881 179.683 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.837 0.351 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -68.17 -29.27 68.1 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.397 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.554 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.9 mt -60.01 -42.8 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.433 0.635 . . . . 0.0 109.63 178.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.623 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.19 -35.93 76.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.172 178.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -62.78 -47.59 82.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.1 mt-10 -89.56 -3.62 58.23 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.1 p -57.13 -32.48 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 118.18 0.445 . . . . 0.0 111.146 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.83 -4.67 58.43 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.922 0.391 . . . . 0.0 110.693 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -106.38 21.56 17.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.728 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.591 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 22.3 8.9 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.391 -0.909 . . . . 0.0 114.254 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 93.75 142.65 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.279 1.032 . . . . 0.0 112.129 177.512 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.6 t -130.74 -31.74 1.73 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.964 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.438 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -54.44 -62.99 5.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.299 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.485 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.14 -37.3 16.29 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.384 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.431 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.8 ttt180 -62.3 -47.41 84.41 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.7 tt0 -63.25 -40.02 96.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.734 0.302 . . . . 0.0 110.632 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.16 -46.38 90.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.171 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.17 -40.21 71.42 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.998 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -82.52 -5.94 59.03 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -59.13 -41.94 89.45 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -85.8 -89.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.48 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.19 -86.91 0.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.293 0.568 . . . . 0.0 110.596 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.406 ' OE1' ' HB2' ' A' ' 23' ' ' PHE . 91.8 mt-30 -112.46 -57.23 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 16.8 ttpp -131.73 -42.45 1.02 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.2 t30 49.28 30.44 3.16 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.135 0.974 . . . . 0.0 111.857 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.406 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 9.6 mptt -139.57 164.24 30.42 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.0 p -124.95 160.16 29.55 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.539 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.8 mp -59.45 -41.85 85.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.971 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.81 99.4 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.914 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.74 -40.28 95.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -29.42 61.01 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.4 mt -59.6 -37.51 78.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -58.97 -46.49 87.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.286 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.6 t -70.51 -39.57 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.727 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 mp -57.78 -39.47 77.55 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.35 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -63.8 -38.85 92.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.142 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -63.17 -40.6 98.0 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.913 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 95.7 mmm -90.4 -10.75 42.73 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.9 39.73 46.02 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.853 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.55 ' NE2' HD23 ' A' ' 37' ' ' LEU . 16.1 m80 -74.28 81.39 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.085 0.469 . . . . 0.0 111.579 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -63.21 -42.2 99.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.57 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.2 tpp85 -62.21 -41.55 98.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.025 0.44 . . . . 0.0 110.761 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.27 -39.17 89.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.305 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.582 ' O ' HG23 ' A' ' 107' ' ' ILE . 95.5 mt -62.66 -42.89 97.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.631 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.16 -41.45 99.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.706 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.457 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.36 -23.51 37.67 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.582 HG23 ' O ' ' A' ' 104' ' ' ILE . 0.9 OUTLIER -64.82 -20.3 27.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.859 0.362 . . . . 0.0 111.251 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.0 p -71.03 -7.25 45.06 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.604 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -68.62 -27.1 65.73 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.758 0.313 . . . . 0.0 110.978 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.223 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.223 -0.335 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.7 t -72.43 125.46 27.44 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.229 0.538 . . . . 0.0 112.422 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -167.56 -178.21 3.85 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.586 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.38 -58.98 2.88 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -72.9 -35.4 67.09 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.608 0.718 . . . . 0.0 110.691 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -110.56 71.33 0.75 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.092 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.43 ' CG ' ' HZ3' ' A' ' 84' ' ' LYS . 95.3 mt -48.24 156.54 0.77 Allowed Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -36.12 163.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.632 3.555 . . . . 0.0 115.176 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.418 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 74.3 Cg_exo -50.52 -8.9 0.16 Allowed 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 123.978 3.119 . . . . 0.0 114.634 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.17 -35.59 64.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -108.3 -79.5 0.58 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 62.4 tp -62.3 -47.68 83.21 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -60.45 -52.26 53.71 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.593 -0.813 . . . . 0.0 114.645 -177.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -71.12 -43.23 68.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.35 -39.73 89.37 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.0 p -73.13 -30.14 63.4 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.847 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -55.82 3.81 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.63 -45.25 95.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 82.6 mt -74.39 -17.82 60.75 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.713 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.653 ' N ' ' HZ3' ' A' ' 71' ' ' LYS . 19.3 t70 -59.56 -38.74 81.9 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.104 0.478 . . . . 0.0 110.541 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.6 p -90.29 10.04 26.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.354 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -66.5 147.24 53.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.18 0.514 . . . . 0.0 111.237 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -136.53 49.54 2.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.242 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.94 -10.3 74.77 Favored Glycine 0 CA--C 1.519 0.34 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.422 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.64 99.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 111.154 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -122.38 -32.39 3.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.17 114.92 1.4 Allowed Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.583 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.461 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 9.0 p90 -55.15 -44.17 74.86 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.036 0.418 . . . . 0.0 110.572 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.461 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 1.5 ppt_? -84.83 -0.5 54.14 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.728 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -48.69 83.41 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.299 -177.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.0 mt -73.28 -41.82 63.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.9 0.381 . . . . 0.0 111.214 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' A' ' 73' ' ' GLY . . . -63.74 -43.1 97.47 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -60.73 -44.38 96.72 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.368 0.417 . . . . 0.0 111.636 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 . . . . . 0 C--N 1.332 -0.186 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 179.366 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.4 t70 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.462 0.172 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.506 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 11.3 p-80 -78.69 -19.11 53.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.823 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.569 ' O ' ' HB3' ' A' ' 72' ' ' SER . 77.8 mt -61.96 -41.18 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 121.303 0.573 . . . . 0.0 110.457 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.605 ' O ' HG12 ' A' ' 67' ' ' VAL . 96.3 mt-10 -69.55 -34.0 73.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.995 178.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.2 mttt -62.4 -47.98 81.74 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.595 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.4 mm-40 -89.5 -4.31 57.98 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.7 p -57.11 -30.82 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 118.233 0.47 . . . . 0.0 110.894 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -88.33 -5.22 58.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.12 0.486 . . . . 0.0 110.596 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -109.36 22.91 15.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.766 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.674 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.61 11.55 30.59 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-O 118.858 -0.968 . . . . 0.0 114.633 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.674 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 105.73 147.76 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.112 1.365 . . . . 0.0 111.744 177.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.597 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.6 t -132.34 -26.06 1.9 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.762 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.479 ' O ' ' HB1' ' A' ' 50' ' ' ALA . . . -58.92 -66.56 2.71 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 119.036 -1.554 . . . . 0.0 111.007 178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -87.03 -40.02 15.1 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.406 ' HB3' ' O ' ' A' ' 71' ' ' LYS . 76.0 ttt-85 -61.55 -47.91 83.41 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.9 tp10 -61.75 -43.05 99.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.515 0.198 . . . . 0.0 110.859 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.1 tp -63.59 -45.74 89.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.588 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.16 -39.11 86.45 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.888 0.375 . . . . 0.0 111.178 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -78.2 -6.27 54.34 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.2 m -59.18 -39.74 83.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -85.9 -90.14 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.198 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.98 -86.49 0.5 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.168 0.509 . . . . 0.0 109.679 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -111.16 -57.61 2.22 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.459 ' HG2' ' H ' ' A' ' 86' ' ' LYS . 17.2 ttpp -133.13 -42.76 0.88 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.71 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.0 t30 49.4 32.84 4.89 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.153 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.59 130.4 26.07 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.72 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 51.5 p -81.55 160.2 23.94 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.991 -0.683 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.5 -38.4 77.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.041 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.4 -39.32 97.62 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.915 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.98 -45.19 93.58 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.583 ' O ' HD11 ' A' ' 95' ' ' LEU . 0.2 OUTLIER -78.01 -23.94 48.1 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.397 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.2 tp -58.98 -40.92 86.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.087 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -61.92 -41.48 97.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 110.265 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 76.5 t -67.98 -41.55 84.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.154 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.583 HD11 ' O ' ' A' ' 91' ' ' LEU . 6.5 mp -60.15 -39.21 85.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.119 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -62.94 -40.63 98.23 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -65.19 -42.89 93.17 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.566 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.43 -38.56 81.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.196 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.69 26.15 39.51 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.612 -0.804 . . . . 0.0 113.464 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.538 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 20.7 t-160 -77.48 106.16 9.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.098 0.449 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.96 -42.23 97.33 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -62.57 -42.25 99.43 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.865 0.364 . . . . 0.0 110.96 -179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.538 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -61.63 -42.04 98.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.497 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.643 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.2 mt -64.24 -43.28 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.38 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -61.0 -47.96 84.03 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.443 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.48 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -76.99 -24.94 52.22 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.9 tt -64.7 -20.68 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 120.816 0.341 . . . . 0.0 111.723 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 72.2 p -75.62 -8.09 55.92 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.595 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -87.49 16.09 5.88 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.029 0.442 . . . . 0.0 111.238 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 58.9 t80 . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.672 179.028 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 120.457 0.17 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -70.79 120.03 15.8 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.12 164.45 20.29 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.484 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.43 -50.37 70.03 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.62 -35.36 14.27 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.143 0.496 . . . . 0.0 111.589 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -103.61 70.8 1.04 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.46 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' CG ' ' HZ1' ' A' ' 84' ' ' LYS . 92.0 mt -43.51 157.51 0.26 Allowed Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 124.283 0.989 . . . . 0.0 112.454 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -42.32 167.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 124.621 3.547 . . . . 0.0 113.845 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 87.3 Cg_exo -48.73 -9.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.821 3.014 . . . . 0.0 115.083 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.5 -35.36 67.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.868 0.303 . . . . 0.0 110.937 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.543 HD13 ' CB ' ' A' ' 91' ' ' LEU . 8.0 tp -107.24 -77.55 0.6 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -49.75 71.11 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.402 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -59.34 -52.29 54.08 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.559 -0.829 . . . . 0.0 115.049 -177.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.8 tm-20 -71.28 -43.82 66.42 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.449 ' CD1' HD12 ' A' ' 29' ' ' LEU . 91.6 mt -66.68 -39.58 88.2 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.625 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 19.2 p -74.32 -32.97 63.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.191 -0.604 . . . . 0.0 112.17 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.7 -54.52 4.48 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 56.9 t -64.19 -44.83 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.501 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 mt -75.64 -17.23 60.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.37 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 36.5 t0 -60.66 -37.13 80.56 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.054 0.454 . . . . 0.0 110.967 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.9 m -85.72 9.6 15.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.128 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.473 ' SG ' HD11 ' A' ' 44' ' ' LEU . 48.3 t -66.18 144.66 56.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.254 0.549 . . . . 0.0 111.883 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -133.63 46.26 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.87 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.4 -11.99 70.51 Favored Glycine 0 CA--C 1.519 0.33 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.391 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.82 -42.46 97.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.956 0.407 . . . . 0.0 111.551 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.473 HD11 ' SG ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -117.05 -26.15 6.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.308 179.095 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.466 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.63 108.07 0.25 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.165 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.49 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 16.0 p90 -54.89 -40.3 69.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 117.211 0.505 . . . . 0.0 111.125 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.04 1.06 41.99 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.996 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.71 -43.52 96.31 Favored Glycine 0 C--N 1.329 0.177 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.713 -178.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.41 -42.4 68.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.768 0.318 . . . . 0.0 111.003 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.64 ' HB1' ' O ' ' A' ' 73' ' ' GLY . . . -65.54 -40.59 93.06 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.03 -41.11 97.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.996 -178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.854 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 120.992 0.425 . . . . 0.0 110.672 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -74.38 -22.43 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.419 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.48 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.86 -43.73 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.11 0.481 . . . . 0.0 110.5 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.593 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.9 mt-10 -66.94 -36.58 82.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.957 0.408 . . . . 0.0 110.935 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.34 -47.2 83.15 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -177.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.527 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 6.1 mt-10 -90.05 -4.08 57.59 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.593 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.1 p -56.54 -32.62 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.209 0.459 . . . . 0.0 111.235 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.82 -4.73 58.41 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.853 178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -106.08 21.31 17.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.907 -178.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.626 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.62 21.15 10.01 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.259 -0.972 . . . . 0.0 114.233 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.626 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 98.9 148.01 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.568 1.147 . . . . 0.0 112.04 177.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.527 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.1 t -137.13 -37.26 0.65 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.659 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.64 ' O ' ' HB1' ' A' ' 50' ' ' ALA . . . -50.68 -62.8 4.94 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.931 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.2 t -88.21 -36.06 16.99 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.266 0.533 . . . . 0.0 111.712 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.18 -47.27 85.24 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.2 tt0 -62.58 -40.14 95.93 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.645 0.26 . . . . 0.0 110.641 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.51 -46.96 87.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.1 mt -72.26 -39.88 68.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.566 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -78.09 -6.77 55.71 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.9 p -57.86 -38.63 76.05 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -87.38 -91.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.016 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.94 -86.8 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -108.7 -57.87 2.08 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.54 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 23.2 ttpp -133.07 -43.84 0.87 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.94 176.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.2 t30 47.97 34.7 4.3 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.556 0.742 . . . . 0.0 111.911 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -139.45 168.14 20.49 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 64.8 p -124.84 158.59 33.07 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.528 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.498 HD11 HD11 ' A' ' 29' ' ' LEU . 1.2 mm -60.56 -37.66 75.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.924 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.91 -41.35 99.27 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.716 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.47 -42.34 83.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.057 0.456 . . . . 0.0 111.036 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.543 ' CB ' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -75.59 -24.14 56.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.802 -179.476 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.52 -42.14 91.57 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.945 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -62.09 -41.59 98.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.433 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -69.09 -41.24 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.062 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 mp -59.91 -42.96 95.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.253 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -63.9 -40.8 97.33 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.204 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -63.95 -46.71 83.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.4 mmm -70.29 -38.57 75.04 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.73 40.0 5.41 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.446 -0.883 . . . . 0.0 113.266 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -78.44 97.18 5.58 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.994 0.397 . . . . 0.0 110.588 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.509 ' O ' HG12 ' A' ' 104' ' ' ILE . 83.6 mtp180 -63.67 -41.83 98.13 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.691 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -65.41 -37.56 87.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.044 0.449 . . . . 0.0 111.666 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.31 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.681 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.593 ' O ' HG22 ' A' ' 107' ' ' ILE . 36.9 pt -69.03 -25.76 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.429 -179.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.532 ' O ' HG21 ' A' ' 108' ' ' THR . 77.1 m-70 -70.56 -39.97 73.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.863 0.364 . . . . 0.0 110.717 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.403 HD12 ' OD1' ' A' ' 109' ' ' ASN . 0.2 OUTLIER -84.93 -22.8 29.11 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.593 HG22 ' O ' ' A' ' 104' ' ' ILE . 13.6 tt -61.97 -21.18 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.642 0.258 . . . . 0.0 111.328 -179.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 105' ' ' HIS . 7.4 t -65.77 -16.71 64.04 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.598 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . 0.403 ' OD1' HD12 ' A' ' 106' ' ' LEU . 27.4 m120 -78.1 -10.44 59.62 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 0.0 111.421 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.528 179.026 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.219 -0.535 0 N-CA-C 111.442 0.164 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.4 m -78.64 113.91 17.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.492 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 20.6 mt -155.96 165.58 36.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.005 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.6 tp -62.77 -49.46 74.91 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -83.27 -35.39 25.35 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.156 0.503 . . . . 0.0 112.007 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -113.09 71.23 0.74 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.703 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.422 ' CG ' ' HZ2' ' A' ' 84' ' ' LYS . 86.1 mt -41.0 155.4 0.21 Allowed Pre-proline 0 CA--C 1.54 0.577 0 O-C-N 123.926 0.766 . . . . 0.0 112.008 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -38.01 164.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 125.041 3.827 . . . . 0.0 114.848 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.21 -9.17 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 124.131 3.221 . . . . 0.0 115.18 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.55 64.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 117.634 0.197 . . . . 0.0 110.521 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.422 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.91 -79.12 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.21 -47.44 84.42 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.51 -51.12 60.69 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.523 -0.846 . . . . 0.0 114.14 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.449 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.96 -43.26 68.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.59 -38.68 84.38 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.624 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -73.97 -30.85 62.72 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.644 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.5 -57.35 3.1 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.66 -45.58 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.61 -19.51 61.45 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.485 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.624 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 37.0 t0 -61.29 -37.29 82.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 110.28 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -85.69 1.65 48.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.014 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.473 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 52.4 t -63.45 139.34 58.76 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.224 0.535 . . . . 0.0 111.553 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.52 45.78 2.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.938 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.04 -10.96 73.01 Favored Glycine 0 CA--C 1.52 0.35 0 CA-C-N 115.535 -0.757 . . . . 0.0 113.127 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.11 98.76 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.994 0.397 . . . . 0.0 111.347 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.68 -23.6 9.15 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.473 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 80.78 110.37 0.3 Allowed Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.393 -178.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.9 p90 -50.95 -50.35 58.11 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 117.293 0.546 . . . . 0.0 110.627 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ptt85 -84.04 1.33 44.41 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.694 177.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.91 -49.11 73.56 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.3 -177.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.25 -41.63 69.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.073 0.437 . . . . 0.0 111.372 179.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.68 -41.4 96.08 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -60.55 -42.63 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.934 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.106 179.93 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 121.174 0.511 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -70.74 -27.72 64.16 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.842 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.537 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.1 mt -59.97 -42.71 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.129 0.49 . . . . 0.0 110.572 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.609 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.4 mt-10 -65.92 -36.53 83.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.458 . . . . 0.0 110.847 178.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.53 -49.14 74.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.535 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 1.4 mm-40 -89.95 -3.45 58.03 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.609 HG11 ' O ' ' A' ' 64' ' ' GLU . 6.2 p -56.18 -33.42 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 118.177 0.444 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.05 -4.34 58.4 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.808 0.337 . . . . 0.0 110.762 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.97 21.57 17.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.883 -178.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.609 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.86 20.79 10.24 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.282 -0.961 . . . . 0.0 114.269 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.609 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.0 OUTLIER 95.82 141.52 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.388 1.075 . . . . 0.0 112.161 177.493 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.689 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.4 t -131.12 -28.8 1.9 Allowed 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.331 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -56.23 -63.14 5.58 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.745 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.468 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.84 -40.12 13.36 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 179.224 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.457 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 76.9 ttt180 -62.31 -49.89 73.83 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -177.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.689 ' HB3' ' O ' ' A' ' 72' ' ' SER . 52.4 tp10 -64.51 -39.19 93.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.295 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.0 tp -60.51 -46.52 89.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.937 0.399 . . . . 0.0 110.338 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 85.7 mt -71.5 -39.59 70.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.195 0.522 . . . . 0.0 111.197 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -74.55 -6.47 48.65 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.616 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 t -58.03 -42.1 84.63 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 61.5 m95 -85.73 -90.05 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.988 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.71 -86.26 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.216 0.532 . . . . 0.0 109.575 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.48 -56.95 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.422 ' HZ2' ' CG ' ' A' ' 25' ' ' LEU . 21.5 ttpp -132.02 -42.68 0.99 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.482 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 45.63 34.01 1.6 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.669 0.788 . . . . 0.0 112.563 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.5 169.01 18.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.3 p -119.38 158.32 26.41 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.469 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.23 -38.26 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.057 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.31 -39.6 97.95 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.824 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.83 -46.53 87.5 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.752 0.279 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.58 ' O ' HD11 ' A' ' 95' ' ' LEU . 1.2 mm? -76.32 -24.49 54.31 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.286 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.07 -38.1 78.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -60.93 -41.83 96.98 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.839 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.495 HG21 ' O ' ' A' ' 91' ' ' LEU . 28.9 m -83.09 -23.95 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.121 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.58 HD11 ' O ' ' A' ' 91' ' ' LEU . 2.8 mp -62.78 -46.61 87.21 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 110.334 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.69 -39.44 91.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.626 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -63.29 -43.5 97.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.652 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -68.69 -38.75 80.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.88 22.86 19.51 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.095 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.448 ' CD2' ' HB2' ' A' ' 103' ' ' ALA . 1.2 t60 -78.08 99.02 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.087 0.47 . . . . 0.0 110.996 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.69 -40.8 96.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.809 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.19 -41.4 96.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.856 0.36 . . . . 0.0 110.739 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.448 ' HB2' ' CD2' ' A' ' 100' ' ' HIS . . . -61.31 -39.49 90.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.304 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.635 ' O ' HG23 ' A' ' 107' ' ' ILE . 44.2 mm -63.97 -43.66 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.749 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -64.64 -40.78 96.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.648 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.449 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -79.79 -22.78 42.72 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.635 HG23 ' O ' ' A' ' 104' ' ' ILE . 2.5 tp -64.55 -20.84 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.511 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.1 p -74.09 -10.18 59.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -89.03 16.28 7.32 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.195 0.522 . . . . 0.0 111.187 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.307 179.456 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 C--O 1.221 -0.398 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.2 m -67.64 119.66 12.76 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.74 0.305 . . . . 0.0 111.72 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.17 163.3 22.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.428 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.0 tp -64.38 -50.58 67.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -85.25 -35.38 21.6 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.565 0.697 . . . . 0.0 111.325 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.5 70.44 0.73 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.348 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.401 HD11 ' CE1' ' A' ' 110' ' ' TYR . 94.7 mt -45.84 155.52 0.49 Allowed Pre-proline 0 N--CA 1.466 0.356 0 O-C-N 124.161 0.913 . . . . 0.0 111.387 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -35.4 160.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 124.683 3.589 . . . . 0.0 114.888 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -49.39 -9.17 0.11 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.338 3.359 . . . . 0.0 114.889 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.05 62.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.71 0.232 . . . . 0.0 110.676 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.413 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 7.5 tp -107.85 -78.28 0.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -61.32 -48.73 80.01 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.64 -52.73 48.93 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.676 -0.773 . . . . 0.0 114.817 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -72.2 -42.01 66.27 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -38.76 90.93 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.6 p -72.15 -29.46 64.06 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.357 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -59.42 2.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.03 -44.44 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.81 -19.17 62.7 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.649 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.414 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 13.6 t70 -60.99 -37.15 81.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.982 0.42 . . . . 0.0 110.625 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 m -81.22 1.56 31.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.509 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 50.3 t -64.16 139.01 58.72 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.316 0.579 . . . . 0.0 111.916 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -129.4 43.67 3.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.358 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 95.26 -13.84 66.16 Favored Glycine 0 CA--C 1.521 0.424 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.791 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.88 97.12 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.762 0.315 . . . . 0.0 111.704 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.422 ' O ' ' HE1' ' A' ' 98' ' ' MET . 83.5 mt -112.61 -17.34 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.113 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.509 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 72.49 105.54 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.549 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -51.63 -52.51 47.19 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.361 0.581 . . . . 0.0 110.338 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 49.1 ptt85 -84.7 -0.32 53.14 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.651 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.41 -39.05 92.34 Favored Glycine 0 N--CA 1.46 0.276 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.87 -178.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.15 -45.41 12.08 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.787 0.327 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.49 97.48 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -61.41 -41.16 96.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.011 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 . . . . . 0 C--O 1.232 0.175 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.368 179.716 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.695 0.283 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.7 p-80 -85.68 -14.71 44.64 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.557 ' O ' ' HB3' ' A' ' 72' ' ' SER . 76.4 mt -59.8 -40.43 82.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 121.406 0.622 . . . . 0.0 109.518 178.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.517 ' O ' HG12 ' A' ' 67' ' ' VAL . 97.6 mt-10 -72.13 -21.33 61.48 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.601 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -73.85 -52.7 12.18 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 18.1 mt-10 -86.85 -3.51 59.08 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.2 p -57.36 -34.31 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.914 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -89.58 -4.52 57.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.07 0.462 . . . . 0.0 110.571 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -107.12 22.75 15.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.717 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.576 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 105.11 20.4 9.8 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.302 -0.951 . . . . 0.0 114.037 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 92.79 141.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.364 1.065 . . . . 0.0 112.155 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.557 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.2 t -130.18 -28.64 2.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.037 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.28 -64.49 4.34 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.072 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.446 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -87.68 -36.33 17.48 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.419 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.8 ttt180 -61.66 -47.98 82.89 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.622 -178.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 13.3 tm-20 -62.55 -40.71 97.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.62 0.248 . . . . 0.0 110.647 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.4 tp -60.55 -46.65 89.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.37 -39.11 74.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.89 0.376 . . . . 0.0 111.721 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -78.35 -4.93 50.55 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.9 m -58.12 -40.16 80.54 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -86.54 -90.39 0.11 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.983 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.41 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . . . -108.3 -86.92 0.5 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' OE1' ' HB2' ' A' ' 82' ' ' ALA . 22.3 mp0 -110.6 -56.97 2.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.413 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 19.3 ttpp -132.54 -43.7 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.2 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 t30 48.03 35.74 5.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.702 0.801 . . . . 0.0 111.605 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.43 171.24 14.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.713 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.3 p -123.78 158.42 31.79 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.221 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.63 -41.28 84.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.268 -179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -39.8 98.14 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.815 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.47 -45.89 88.72 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.526 ' O ' HD12 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -76.28 -24.88 54.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.456 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.96 -41.3 87.17 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.177 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.13 -42.81 99.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.855 0.359 . . . . 0.0 110.956 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 79.5 t -70.52 -43.63 77.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.294 0.569 . . . . 0.0 110.696 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.526 HD12 ' O ' ' A' ' 91' ' ' LEU . 7.1 mp -61.83 -38.62 88.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.199 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -60.09 -39.98 88.02 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -62.77 -44.51 95.99 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.424 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.422 ' HE1' ' O ' ' A' ' 44' ' ' LEU . 90.4 mmm -69.87 -38.89 76.54 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 104.32 42.6 1.87 Allowed Glycine 0 CA--C 1.523 0.55 0 C-N-CA 119.79 -1.195 . . . . 0.0 113.291 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.482 ' ND1' ' HB3' ' A' ' 95' ' ' LEU . 26.8 p-80 -56.78 111.67 1.09 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.181 0.515 . . . . 0.0 112.355 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -85.4 -64.37 1.17 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -65.94 -35.87 81.79 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.043 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.557 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.52 ' O ' HG21 ' A' ' 107' ' ' ILE . 87.1 mt -60.13 -40.54 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 121.205 0.526 . . . . 0.0 109.878 178.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -59.45 -48.34 82.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.561 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.5 -25.46 28.82 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.52 HG21 ' O ' ' A' ' 104' ' ' ILE . 13.1 tt -61.59 -20.71 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 122.166 -0.334 . . . . 0.0 111.315 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.3 p -71.8 -10.15 59.35 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.384 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.93 -27.71 66.0 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 111.051 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.401 ' CE1' HD11 ' A' ' 25' ' ' LEU . 82.2 t80 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 120.881 0.372 . . . . 0.0 110.072 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 . . . . . 0 C--O 1.221 -0.413 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.1 m -66.88 114.98 6.14 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.747 0.308 . . . . 0.0 111.771 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.71 174.2 9.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.729 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.84 -57.63 3.56 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -72.24 -35.85 68.94 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.532 0.682 . . . . 0.0 110.808 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -111.85 69.96 0.7 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.243 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.404 ' CG ' ' HZ2' ' A' ' 84' ' ' LYS . 93.6 mt -46.34 156.02 0.52 Allowed Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.451 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.53 163.5 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 124.854 3.703 . . . . 0.0 114.635 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.77 -8.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 124.386 3.39 . . . . 0.0 115.027 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.87 -35.85 64.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.919 0.327 . . . . 0.0 110.532 179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.423 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.9 tp -108.1 -78.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.546 HD12 ' SG ' ' A' ' 34' ' ' CYS . 46.1 tp -61.55 -47.35 85.94 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -177.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.89 -52.2 49.95 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.692 -0.766 . . . . 0.0 114.988 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 32.3 tp10 -72.71 -43.7 62.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.11 -40.72 94.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.435 -0.506 . . . . 0.0 112.324 -178.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.653 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 67.6 m -70.79 -43.84 67.86 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.45 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.75 -50.48 24.23 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.17 -43.38 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.563 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 84.7 mt -78.77 -15.9 57.85 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.626 -179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.4 t70 -58.77 -39.46 81.06 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.148 0.499 . . . . 0.0 110.8 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.5 m -90.53 10.03 27.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.023 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.1 t -68.13 142.43 55.76 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -137.92 57.66 1.71 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.178 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.46 -10.97 73.2 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.554 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.33 98.19 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.255 0.527 . . . . 0.0 111.019 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -126.14 -32.87 2.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.88 115.39 1.83 Allowed Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.625 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.6 p90 -54.38 -46.08 72.97 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.226 0.513 . . . . 0.0 110.846 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -83.49 -0.09 48.67 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.73 -47.65 89.19 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.297 -0.954 . . . . 0.0 113.465 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.3 mt -72.15 -42.66 65.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.055 0.427 . . . . 0.0 111.217 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.48 -39.87 92.45 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.19 -44.34 95.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.311 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 . . . . . 0 N--CA 1.465 0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.026 179.801 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 CA--C 1.531 0.231 0 CA-C-O 120.585 0.231 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.432 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.7 t60 -73.87 -28.25 61.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.632 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.614 ' O ' ' HB3' ' A' ' 72' ' ' SER . 85.2 mt -59.54 -41.55 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 121.289 0.566 . . . . 0.0 110.32 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.59 ' O ' HG13 ' A' ' 67' ' ' VAL . 80.9 mm-40 -67.09 -34.96 78.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 178.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.4 mttt -62.53 -49.21 76.24 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -177.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.518 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.2 mt-10 -89.47 -3.64 58.29 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.59 HG13 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -54.86 -28.7 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 118.116 0.416 . . . . 0.0 111.502 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.68 -4.73 58.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 111.179 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -106.47 22.32 16.0 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.895 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.717 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 12.01 30.72 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-O 118.567 -1.129 . . . . 0.0 113.605 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.717 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.8 tppp? 108.34 149.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.97 1.308 . . . . 0.0 112.227 177.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.614 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -134.36 -19.79 1.9 Allowed 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.495 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -60.78 -67.76 1.98 Allowed Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.605 -1.283 . . . . 0.0 111.72 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.403 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 6.2 m -88.11 -33.85 18.11 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.508 -0.407 . . . . 0.0 111.057 179.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -61.44 -45.74 93.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.839 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.9 tt0 -61.68 -41.57 97.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.602 0.239 . . . . 0.0 110.477 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.1 tp -61.76 -46.24 90.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.5 mt -67.69 -39.23 84.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.872 0.368 . . . . 0.0 111.145 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -80.96 -4.94 56.75 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.2 m -58.45 -40.05 81.58 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -86.26 -89.61 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -86.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.121 0.486 . . . . 0.0 109.745 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -114.29 -54.64 2.57 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.423 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 18.5 ttpp -132.26 -43.9 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.6 t30 47.41 34.87 3.57 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.826 0.85 . . . . 0.0 111.703 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 170.79 15.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.648 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.0 p -122.86 158.6 29.94 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.036 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.39 -38.18 73.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.08 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.57 98.13 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.104 -0.57 . . . . 0.0 112.756 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.22 -46.43 87.03 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.469 ' O ' HG21 ' A' ' 94' ' ' VAL . 1.1 mm? -74.18 -24.13 59.33 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.154 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.6 tp -59.16 -37.66 77.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.061 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.0 -41.69 97.02 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.836 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.469 HG21 ' O ' ' A' ' 91' ' ' LEU . 16.8 m -83.65 -23.26 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.183 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.435 HD12 ' O ' ' A' ' 91' ' ' LEU . 1.6 mp -63.42 -41.09 98.7 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 109.843 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.77 -37.75 87.17 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.558 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -61.65 -40.52 95.2 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.68 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.4 mmt -89.42 -12.97 38.73 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.608 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.83 37.97 65.83 Favored Glycine 0 CA--C 1.52 0.401 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.748 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.595 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 19.3 t-160 -78.05 95.29 4.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.318 0.559 . . . . 0.0 110.218 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.63 -40.86 96.21 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.096 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -61.19 -39.89 91.89 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.688 0.28 . . . . 0.0 111.291 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.595 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -61.31 -38.78 88.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.397 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.583 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -62.15 -42.95 97.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.953 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.516 ' O ' HG22 ' A' ' 108' ' ' THR . 83.7 m-70 -63.38 -40.8 98.22 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.434 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -84.16 -21.77 31.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.7 tp -61.72 -21.0 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 120.696 0.284 . . . . 0.0 111.514 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 105' ' ' HIS . 7.5 t -67.86 -13.94 62.55 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -74.29 -10.82 59.97 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 111.665 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 68.2 t80 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.033 0.444 . . . . 0.0 111.143 179.256 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.8 m80 . . . . . 0 C--O 1.219 -0.535 0 CA-C-O 120.262 0.077 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.4 m -76.42 122.6 24.75 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.29 166.88 20.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.438 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.5 tp -63.66 -49.81 71.76 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.84 -33.73 22.81 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.344 0.593 . . . . 0.0 111.292 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.3 72.47 0.78 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.529 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.2 mt -46.73 156.83 0.5 Allowed Pre-proline 0 CA--C 1.541 0.599 0 O-C-N 123.415 0.447 . . . . 0.0 111.282 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -37.78 162.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.364 1.342 0 C-N-CA 124.877 3.718 . . . . 0.0 115.126 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.13 -9.35 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 124.338 3.359 . . . . 0.0 115.11 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.38 -35.02 62.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.825 0.284 . . . . 0.0 110.998 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.502 ' HB3' ' HE3' ' A' ' 84' ' ' LYS . 4.1 tp -108.49 -78.28 0.59 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.66 -48.44 80.79 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.9 -51.74 56.72 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.645 -0.788 . . . . 0.0 114.249 -178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.47 ' OE2' HG21 ' A' ' 36' ' ' VAL . 46.3 tp10 -70.21 -44.03 69.47 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.39 -39.0 81.84 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.4 p -71.82 -30.93 66.01 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.689 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.14 -56.76 3.38 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.47 HG21 ' OE2' ' A' ' 32' ' ' GLU . 54.5 t -64.69 -44.71 96.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.85 -18.04 61.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.607 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.448 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 12.7 t70 -58.41 -38.56 77.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 110.755 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.5 m -90.39 7.72 37.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.095 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.0 t -65.75 140.63 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.229 0.537 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -135.46 54.61 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.145 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.66 -10.58 73.8 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 115.692 -0.685 . . . . 0.0 113.607 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.52 98.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 117.255 0.528 . . . . 0.0 111.007 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -123.4 -26.63 4.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.76 114.86 0.83 Allowed Glycine 0 N--CA 1.444 -0.78 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.755 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.405 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 p90 -53.58 -46.47 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.191 0.495 . . . . 0.0 110.403 178.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.8 ptt85 -83.75 1.33 43.32 Favored 'General case' 0 C--O 1.213 -0.865 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.797 177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.9 -44.86 94.22 Favored Glycine 0 C--O 1.23 -0.134 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.252 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -72.88 -43.51 62.42 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.036 0.418 . . . . 0.0 111.194 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -65.37 -39.55 92.42 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.48 -42.87 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.048 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.132 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.544 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.461 0.123 0 CA-C-O 120.863 0.363 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.418 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 15.0 t60 -84.04 -18.38 37.21 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.24 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.491 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -60.41 -41.49 87.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.089 0.471 . . . . 0.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.584 ' O ' HG11 ' A' ' 67' ' ' VAL . 99.0 mt-10 -64.64 -38.68 91.84 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 33.5 mttm -65.89 -46.15 79.43 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -177.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.512 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.98 -3.81 57.8 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.584 HG11 ' O ' ' A' ' 64' ' ' GLU . 8.3 p -56.11 -35.59 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-N 118.18 0.446 . . . . 0.0 111.392 -179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.36 -4.62 58.0 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.966 0.412 . . . . 0.0 110.862 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -104.83 22.21 15.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.869 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.54 21.48 9.22 Favored Glycine 0 CA--C 1.52 0.375 0 C-N-CA 120.409 -0.901 . . . . 0.0 114.191 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.31 141.13 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.302 1.041 . . . . 0.0 112.004 177.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.6 t -130.73 -30.74 1.82 Allowed 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.236 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.543 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -54.65 -64.33 4.43 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.309 -0.948 . . . . 0.0 112.316 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.455 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 22.8 m -87.74 -38.53 15.71 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 122.725 -0.279 . . . . 0.0 111.692 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.416 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.5 ttt180 -60.54 -48.36 82.13 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.535 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -63.29 -39.68 95.24 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.772 0.32 . . . . 0.0 110.677 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.08 -46.85 88.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.559 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 88.2 mt -71.31 -39.13 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.1 0.476 . . . . 0.0 111.19 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -76.25 -7.03 53.99 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -178.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.7 p -57.66 -38.94 75.94 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 m95 -87.62 -89.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.484 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -87.22 0.49 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -115.63 -52.37 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.502 ' HE3' ' HB3' ' A' ' 29' ' ' LEU . 1.5 ttpm? -132.25 -44.75 0.93 Allowed 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.0 t30 47.09 35.85 3.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.503 0.721 . . . . 0.0 111.307 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.32 16.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.986 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 61.9 p -119.27 155.24 32.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.68 -39.72 80.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.608 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.93 -39.21 97.24 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.743 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.17 -45.84 89.94 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -23.88 53.19 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.01 -41.65 88.25 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.037 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.2 -41.25 98.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.606 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.17 -40.25 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.174 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.62 -36.94 82.19 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.27 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -60.92 -39.68 90.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.854 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -63.44 -44.2 95.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.936 0.398 . . . . 0.0 110.408 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 37.4 mmt -68.87 -36.56 78.25 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.956 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.53 30.17 27.93 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.525 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.494 ' CD2' ' HB1' ' A' ' 103' ' ' ALA . 0.8 OUTLIER -74.41 97.33 3.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.147 0.498 . . . . 0.0 110.927 -179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.33 -41.66 96.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.663 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . 0.4 ' HB3' ' CE1' ' A' ' 100' ' ' HIS . 25.8 tpp180 -62.16 -41.33 98.2 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.901 0.381 . . . . 0.0 110.872 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.93 -39.11 88.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.24 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.589 ' O ' HG22 ' A' ' 107' ' ' ILE . 41.2 mm -62.41 -43.67 98.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.794 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -63.55 -42.08 98.41 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -22.96 31.35 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.6 tt -66.09 -20.54 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 120.84 0.353 . . . . 0.0 111.429 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.1 p -70.47 -10.94 60.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.836 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -69.87 -26.33 64.14 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 0.0 110.917 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.6 t80 . . . . . 0 CA--C 1.531 0.228 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.237 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.4 m80 . . . . . 0 C--O 1.221 -0.418 0 N-CA-C 111.356 0.132 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 t -70.37 114.14 8.2 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -163.7 175.03 10.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.6 178.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mp -80.31 -57.87 3.4 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -71.51 -36.13 70.97 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.623 0.725 . . . . 0.0 110.589 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -112.42 69.76 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.334 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.43 ' CG ' ' HZ1' ' A' ' 84' ' ' LYS . 83.8 mt -47.14 157.46 0.5 Allowed Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.824 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -39.71 165.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 124.86 3.707 . . . . 0.0 114.182 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.412 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 77.6 Cg_exo -49.85 -9.36 0.15 Allowed 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.932 3.088 . . . . 0.0 114.979 -178.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.18 -35.29 67.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.773 0.26 . . . . 0.0 110.933 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.552 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 8.1 tp -107.88 -77.8 0.59 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -49.38 73.73 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -59.76 -51.79 56.85 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 -177.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -71.28 -43.49 67.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD1' HD12 ' A' ' 29' ' ' LEU . 83.8 mt -67.86 -38.86 83.62 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -178.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.8 p -74.18 -32.1 62.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.822 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.96 -56.33 3.53 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.429 HG12 ' NE2' ' A' ' 100' ' ' HIS . 69.3 t -64.43 -45.25 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.8 -17.9 61.53 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.056 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.494 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.0 t70 -59.22 -37.79 78.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.979 0.419 . . . . 0.0 110.892 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.6 m -86.98 6.51 31.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.193 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.458 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 41.9 t -65.14 142.03 58.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.206 0.527 . . . . 0.0 111.458 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -131.42 46.19 2.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.155 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.12 -11.79 71.2 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.637 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.16 -43.32 98.6 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.099 0.476 . . . . 0.0 111.059 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -114.67 -24.89 8.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.296 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.458 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.76 113.96 0.26 Allowed Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.222 -178.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.5 p90 -53.03 -46.01 68.24 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 117.429 0.614 . . . . 0.0 110.388 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -84.01 1.3 44.46 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.012 177.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.77 -50.87 60.54 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.952 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.86 -41.87 67.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.281 0.54 . . . . 0.0 111.302 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.52 94.6 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -59.92 -44.11 94.51 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.19 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.039 179.866 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.527 0.076 0 CA-C-O 120.886 0.374 . . . . 0.0 110.59 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -73.55 -24.95 60.18 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.287 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.539 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.19 -40.27 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.198 0.523 . . . . 0.0 110.678 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.435 ' O ' HG13 ' A' ' 67' ' ' VAL . 79.4 mm-40 -69.77 -20.67 63.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.571 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.91 -52.49 8.77 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.495 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 3.7 mt-10 -86.48 -3.38 59.0 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 64' ' ' GLU . 8.2 p -55.52 -34.81 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 117.947 0.34 . . . . 0.0 111.134 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.14 -4.59 58.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.774 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -105.12 21.94 16.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.614 -178.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.5 22.79 8.33 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 114.223 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.93 139.05 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.389 1.076 . . . . 0.0 112.17 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.539 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -131.4 -20.79 2.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.696 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.65 -67.57 2.07 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.832 -1.175 . . . . 0.0 111.669 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.7 m -87.78 -35.03 18.09 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 122.612 -0.346 . . . . 0.0 111.573 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.86 -47.76 84.89 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.496 -177.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.9 tt0 -62.5 -40.51 96.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.689 0.281 . . . . 0.0 110.908 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.0 -47.15 86.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.834 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.2 mt -71.05 -39.85 72.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.056 0.455 . . . . 0.0 111.483 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 26.2 t-105 -77.83 -6.89 55.66 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.368 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -58.59 -42.16 87.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 60.1 m95 -85.63 -89.09 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.08 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.93 -86.59 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.176 0.512 . . . . 0.0 109.725 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -113.98 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.552 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 20.7 ttpp -131.92 -43.97 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.005 175.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.3 t30 48.09 31.48 2.52 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.099 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.27 169.51 17.64 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 78.4 p -127.28 160.07 32.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.479 HD11 HD11 ' A' ' 29' ' ' LEU . 4.4 mm -59.44 -38.64 76.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.151 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.18 96.61 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.628 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -66.42 -43.84 84.6 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.819 0.343 . . . . 0.0 111.09 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.58 HD12 ' O ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -74.5 -29.1 61.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.42 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.05 -41.03 82.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.05 -43.19 99.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.976 0.417 . . . . 0.0 110.616 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 84.6 t -70.87 -41.17 77.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.527 0.68 . . . . 0.0 110.227 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.403 HD13 ' CB ' ' A' ' 103' ' ' ALA . 61.0 tp -60.82 -40.95 94.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.06 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.95 -39.56 89.97 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.951 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -64.5 -43.29 94.59 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.564 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 54.0 tpp -69.25 -39.99 78.14 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.182 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.48 40.31 23.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.792 -0.718 . . . . 0.0 114.687 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.429 ' NE2' HG12 ' A' ' 36' ' ' VAL . 9.4 t60 -80.92 112.83 18.67 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.631 0.715 . . . . 0.0 110.227 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.9 mmm180 -64.06 -42.44 97.01 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -62.23 -39.67 93.58 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.1 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.403 ' CB ' HD13 ' A' ' 95' ' ' LEU . . . -60.49 -38.46 84.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.528 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.575 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.4 mt -61.32 -43.16 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.455 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . 0.541 ' O ' HG22 ' A' ' 108' ' ' THR . 85.6 m-70 -64.84 -39.46 93.6 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.86 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -30.42 28.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.575 HG22 ' O ' ' A' ' 104' ' ' ILE . 13.6 tt -62.54 -22.67 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' THR . . . . . 0.541 HG22 ' O ' ' A' ' 105' ' ' HIS . 6.0 t -68.77 -6.73 28.33 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -89.02 3.2 52.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 111.457 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.2 t80 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 0.0 109.989 179.079 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.1 m80 . . . . . 0 C--O 1.218 -0.601 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.3 t -81.9 119.27 23.72 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.47 172.02 19.09 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.4 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.6 tp -63.22 -50.34 70.63 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -178.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -91.48 -35.5 14.29 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.449 0.642 . . . . 0.0 110.904 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.79 71.0 1.04 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.082 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.466 HD13 ' CE1' ' A' ' 110' ' ' TYR . 93.6 mt -47.57 156.33 0.67 Allowed Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.717 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -39.33 165.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 125.068 3.846 . . . . 0.0 114.716 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.26 -8.78 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.296 3.331 . . . . 0.0 115.347 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.29 -36.4 66.12 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.118 0.417 . . . . 0.0 110.456 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.433 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -107.76 -77.93 0.59 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -52.55 65.0 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.475 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -59.76 -49.45 78.41 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.684 -0.77 . . . . 0.0 114.683 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -70.94 -44.22 66.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.47 -38.89 81.48 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -74.08 -32.13 63.13 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.889 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.91 -55.25 4.05 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 66.3 t -64.51 -45.21 96.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.75 -19.18 61.42 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.926 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 42.9 t0 -60.31 -36.12 77.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.0 m -86.11 5.76 32.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.183 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.535 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.4 t -65.36 142.19 58.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.399 0.619 . . . . 0.0 111.926 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -130.88 40.32 3.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.582 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 96.12 -15.46 62.92 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.023 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.18 97.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.931 0.365 . . . . 0.0 111.749 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.525 ' HG ' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -108.47 -22.99 12.06 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.173 0.511 . . . . 0.0 109.997 179.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.535 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 76.95 107.61 0.15 Allowed Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.25 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.2 p90 -52.71 -48.47 66.59 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.312 0.556 . . . . 0.0 110.31 178.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -84.17 0.01 50.35 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.599 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.44 -41.76 95.45 Favored Glycine 0 C--N 1.329 0.164 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.45 -177.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.7 mt -84.05 -43.02 15.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.04 0.42 . . . . 0.0 111.186 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.96 94.6 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.591 0.959 . . . . 0.0 113.591 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -60.58 -43.7 97.05 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.147 0.279 . . . . 0.0 111.302 -178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 . . . . . 0 N--CA 1.461 0.11 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.588 179.185 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.5 t70 . . . . . 0 N--CA 1.462 0.174 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -66.65 -26.7 67.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.917 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.529 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.53 -41.87 86.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.342 0.592 . . . . 0.0 109.914 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.596 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.38 -34.79 75.08 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.42 178.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.12 -47.7 83.44 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.577 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 61.8 mm-40 -89.36 -3.38 58.48 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -55.77 -33.59 34.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.294 0.497 . . . . 0.0 111.268 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.61 -4.61 57.74 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.899 0.38 . . . . 0.0 110.721 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -108.53 22.82 15.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.196 -178.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.629 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.74 16.04 18.65 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.169 -1.015 . . . . 0.0 114.734 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 97.83 143.73 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.491 1.116 . . . . 0.0 111.975 177.26 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.577 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.2 t -132.09 -27.81 1.79 Allowed 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.495 178.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.34 2.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 119.962 -1.113 . . . . 0.0 112.204 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.8 m -87.24 -35.96 18.21 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.774 -0.251 . . . . 0.0 111.535 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -60.57 -46.73 89.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.874 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.4 tt0 -62.08 -42.81 99.59 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.476 0.179 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 tp -61.57 -46.42 89.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.463 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 98.3 mt -67.33 -39.54 85.83 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.486 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -80.26 -5.54 56.39 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.5 m -59.07 -40.01 83.87 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -86.4 -90.61 0.11 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.18 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.33 -87.28 0.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 109.717 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -110.47 -56.91 2.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.433 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 17.4 ttpp -132.5 -43.36 0.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.206 176.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 48.51 34.32 4.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.891 0.876 . . . . 0.0 111.883 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.404 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.22 169.3 18.03 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.2 p -125.28 158.62 33.69 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.717 179.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.87 -40.06 81.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.792 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.5 -40.17 98.32 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.733 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.27 -40.79 96.7 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 95' ' ' LEU . 0.2 OUTLIER -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.259 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.16 -40.1 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.113 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -61.7 -41.35 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.906 0.384 . . . . 0.0 110.482 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.2 t -69.32 -41.17 80.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.282 0.563 . . . . 0.0 110.022 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.527 HD12 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -59.06 -36.85 75.74 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.704 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.84 -39.35 94.12 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.353 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -61.9 -47.37 85.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.65 0.262 . . . . 0.0 110.657 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.2 mmm -71.21 -36.22 71.79 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.36 33.06 36.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.331 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.525 ' NE2' ' HG ' ' A' ' 44' ' ' LEU . 32.9 t-80 -66.8 108.25 2.46 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.524 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -63.75 -44.74 92.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -64.39 -41.4 96.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.006 0.432 . . . . 0.0 111.044 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.502 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.91 -40.3 92.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.806 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.595 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -62.72 -45.1 99.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.99 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -65.96 -40.54 91.38 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.03 -22.37 33.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.595 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.9 tp -66.41 -20.79 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.753 0.311 . . . . 0.0 111.161 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.3 p -70.5 -10.25 58.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.934 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -69.92 -26.24 64.05 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.865 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.466 ' CE1' HD13 ' A' ' 25' ' ' LEU . 82.1 t80 . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.266 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 . . . . . 0 C--O 1.221 -0.414 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -72.1 121.0 18.51 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.19 160.35 11.61 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.0 tp -65.85 -51.03 62.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -76.09 -36.73 58.82 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.457 0.646 . . . . 0.0 111.242 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.88 70.9 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.836 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.6 mt -45.43 154.43 0.51 Allowed Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 123.869 0.731 . . . . 0.0 111.848 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -38.04 163.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 125.12 3.88 . . . . 0.0 115.075 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -48.76 -9.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.415 3.41 . . . . 0.0 115.177 -178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.408 ' CB ' ' HA ' ' A' ' 107' ' ' ILE . . . -53.86 -35.29 61.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.784 0.265 . . . . 0.0 110.5 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.508 ' HB3' ' HE3' ' A' ' 84' ' ' LYS . 3.0 tp -108.03 -77.3 0.6 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.197 0.444 . . . . 0.0 112.197 178.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.451 ' HB2' ' HZ2' ' A' ' 84' ' ' LYS . 0.8 OUTLIER -59.89 -53.98 51.54 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -177.867 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.68 -51.75 57.12 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.63 -0.795 . . . . 0.0 115.045 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.491 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 35.8 tp10 -71.3 -43.06 67.82 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.44 -39.32 85.38 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.614 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.4 p -71.46 -29.2 64.58 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.474 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.55 -55.8 3.82 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.8 t -64.14 -44.93 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 88.6 mt -77.56 -16.8 58.42 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 122.068 -0.395 . . . . 0.0 111.846 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 32.5 t70 -59.34 -39.59 83.65 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.134 0.493 . . . . 0.0 110.556 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -93.27 11.42 28.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.003 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 t -67.86 144.68 55.19 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.015 0.436 . . . . 0.0 111.199 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -136.59 54.89 1.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.92 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.07 -12.94 68.85 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.035 -0.602 . . . . 0.0 114.095 178.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.99 98.75 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.564 0.682 . . . . 0.0 110.894 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.519 ' O ' ' HE1' ' A' ' 98' ' ' MET . 85.3 mt -125.38 -30.63 3.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.569 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.5 117.3 0.74 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.237 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.444 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 27.6 p90 -56.24 -42.81 77.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 117.043 0.421 . . . . 0.0 110.743 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 0.0 OUTLIER -84.27 -0.35 52.01 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.671 178.193 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.87 -45.65 94.72 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.548 -0.834 . . . . 0.0 113.235 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.5 mt -72.21 -43.32 64.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.887 0.343 . . . . 0.0 111.262 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -65.4 -41.64 93.45 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -61.71 -43.79 98.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.305 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 . . . . . 0 C--N 1.332 -0.192 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.612 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 120.927 0.394 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -76.29 -24.07 54.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.719 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.511 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.0 mt -59.85 -43.6 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.124 0.488 . . . . 0.0 110.294 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.569 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.7 mt-10 -67.39 -36.24 80.9 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.931 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.85 -49.06 76.38 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.9 mt-10 -90.08 -4.17 57.51 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.569 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.2 p -56.44 -33.71 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.364 0.529 . . . . 0.0 111.226 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.38 -4.25 58.12 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 110.803 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -106.97 22.13 16.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.026 -178.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.65 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.41 20.94 9.7 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.275 -0.964 . . . . 0.0 114.124 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.65 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.2 tppp? 95.72 147.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.447 1.099 . . . . 0.0 112.082 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.538 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.5 t -138.29 -30.91 0.77 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.54 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.563 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -52.88 -66.95 2.36 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.279 -0.963 . . . . 0.0 112.708 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.3 m -87.8 -34.45 18.28 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 122.441 -0.447 . . . . 0.0 111.113 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -60.9 -48.37 82.12 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.812 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.0 tt0 -63.15 -41.19 99.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.641 0.258 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.2 tp -60.89 -47.23 87.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.781 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.6 mt -70.34 -38.51 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.113 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -76.64 -6.62 52.83 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 64.6 m -58.87 -40.29 83.92 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -86.5 -90.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.786 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.438 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . . . -108.26 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.438 ' OE1' ' HB2' ' A' ' 82' ' ' ALA . 22.7 mp0 -112.41 -55.98 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 29' ' ' LEU . 1.2 ttpm? -132.31 -43.75 0.94 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.1 t30 47.76 36.02 5.3 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.752 0.821 . . . . 0.0 111.269 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.0 170.85 15.23 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.802 -178.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.5 p -117.99 155.38 30.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.037 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.14 -39.3 78.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.873 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.8 -39.02 97.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.027 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -62.26 -46.63 87.95 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.98 -23.88 55.35 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.178 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.21 -39.46 82.72 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.027 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 53.3 mt-30 -61.22 -42.16 98.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.04 0.448 . . . . 0.0 110.47 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 99.7 t -71.75 -40.15 69.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.391 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 86.2 mt -61.64 -41.08 97.01 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.209 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 16.6 pt20 -68.67 -28.14 66.61 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.41 -48.83 73.89 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' MET . . . . . 0.519 ' HE1' ' O ' ' A' ' 44' ' ' LEU . 88.7 mmm -71.76 -36.72 70.47 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.437 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.48 40.41 3.43 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.947 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.473 ' CG ' ' HB1' ' A' ' 103' ' ' ALA . 2.5 t-80 -73.87 88.57 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.987 0.422 . . . . 0.0 111.578 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 19.4 mmt85 -62.76 -43.25 99.28 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.3 tpm_? -63.22 -40.01 96.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.819 0.342 . . . . 0.0 111.106 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.48 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.78 -38.27 87.42 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.602 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.593 ' O ' HG22 ' A' ' 107' ' ' ILE . 94.6 mt -61.39 -44.29 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -65.08 -40.78 95.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.581 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.491 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -81.07 -22.39 39.26 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.502 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.593 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.5 tp -63.18 -20.97 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.863 0.363 . . . . 0.0 111.08 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.8 p -73.02 -13.18 61.17 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.621 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . 0.424 ' OD1' HD21 ' A' ' 106' ' ' LEU . 18.3 m120 -74.33 -10.03 59.18 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 CA--C 1.53 0.192 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.021 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.3 m80 . . . . . 0 C--O 1.22 -0.462 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.5 m -78.68 113.38 16.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.387 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 20' ' ' THR . 26.8 mt -154.8 170.61 21.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.76 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.3 tp -63.24 -50.46 70.11 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -92.01 -35.99 13.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.09 0.471 . . . . 0.0 111.583 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.65 70.78 0.88 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.411 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 96.1 mt -45.09 158.84 0.28 Allowed Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.923 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' A' ' 25' ' ' LEU . 2.4 Cg_endo -39.96 165.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 124.67 3.58 . . . . 0.0 114.546 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.404 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 88.3 Cg_exo -48.88 -8.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.038 3.159 . . . . 0.0 114.919 -178.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.49 -36.82 67.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 117.867 0.303 . . . . 0.0 110.273 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.447 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.1 tp -107.8 -78.27 0.59 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tt -60.32 -48.54 81.29 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -61.96 -51.09 59.47 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.331 -0.938 . . . . 0.0 114.436 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.05 -43.3 68.1 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.3 mt -67.36 -37.95 84.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -75.0 -31.97 61.54 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.652 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.51 -58.46 2.66 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.32 -44.8 99.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.512 HD23 ' NE2' ' A' ' 100' ' ' HIS . 76.1 mt -71.91 -19.55 61.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.528 -178.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.534 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 28.2 t0 -61.7 -38.28 87.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.123 0.487 . . . . 0.0 110.591 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.3 p -87.35 1.68 52.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.012 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.9 t -66.89 142.55 57.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.267 0.556 . . . . 0.0 111.634 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -131.51 50.07 2.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.468 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.8 -12.78 68.78 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.821 -0.627 . . . . 0.0 113.65 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.44 98.68 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.159 0.504 . . . . 0.0 111.097 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.1 mt -116.16 -29.41 6.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.51 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.81 107.9 0.55 Allowed Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.241 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.54 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 33.1 p90 -53.81 -44.99 70.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.988 0.394 . . . . 0.0 110.671 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.54 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 0.0 OUTLIER -85.31 -0.51 54.98 Favored 'General case' 0 C--O 1.219 -0.541 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 178.277 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.98 -47.36 91.1 Favored Glycine 0 C--N 1.329 0.166 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.076 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.8 mt -72.55 -42.13 65.0 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.858 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.31 -42.54 99.03 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.12 -42.04 99.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.092 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.231 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.98 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.461 0.109 0 CA-C-O 121.153 0.502 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -80.16 -23.85 40.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.283 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.563 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 80.3 mt -57.96 -44.57 87.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-O 120.616 0.246 . . . . 0.0 111.019 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -67.36 -37.34 83.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.132 0.491 . . . . 0.0 110.838 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.42 -50.27 68.23 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.57 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 52.5 mm-40 -89.75 -5.34 57.07 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.5 p -57.93 -32.79 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-N 118.266 0.485 . . . . 0.0 111.065 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.8 -4.93 58.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.866 0.365 . . . . 0.0 110.516 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -104.78 21.41 16.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.781 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.578 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.8 11.18 33.28 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-O 118.407 -1.218 . . . . 0.0 114.976 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.5 OUTLIER 112.17 141.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.047 1.339 . . . . 0.0 111.624 177.34 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.596 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.8 t -128.54 -35.7 1.92 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.797 178.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.598 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -49.43 -62.11 5.01 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.847 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.495 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -89.55 -43.06 11.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.439 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 75.8 ttt180 -61.77 -47.63 84.29 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.596 ' HB3' ' O ' ' A' ' 72' ' ' SER . 50.3 tp10 -61.88 -43.67 98.38 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.3 -0.16 . . . . 0.0 111.308 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.78 -44.12 94.32 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.62 -39.67 94.13 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.928 0.394 . . . . 0.0 111.057 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -82.13 -6.36 59.13 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.7 m -59.77 -39.48 85.01 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -85.79 -90.67 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.39 -86.33 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.346 0.593 . . . . 0.0 110.018 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -113.25 -57.07 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.447 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 14.9 ttpp -132.12 -42.59 0.98 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.6 t30 49.1 33.62 5.01 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.652 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.65 167.8 21.28 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.5 p -127.23 158.86 36.03 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.67 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.19 -41.95 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.373 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -40.21 98.6 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.72 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.24 -45.62 87.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.771 0.32 . . . . 0.0 111.762 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 0.2 OUTLIER -76.1 -24.69 55.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.63 -179.653 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.15 -41.36 88.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.349 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.39 -41.59 98.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.138 0.495 . . . . 0.0 110.427 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.42 -39.86 76.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.416 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 90.6 mt -61.13 -40.26 93.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.608 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.93 -40.34 96.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.942 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.16 -48.03 81.88 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.38 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -71.11 -37.64 72.36 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.8 40.07 2.99 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.206 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.512 ' NE2' HD23 ' A' ' 37' ' ' LEU . 37.4 m80 -78.32 83.41 4.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -63.31 -41.46 98.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.144 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.3 tpp180 -63.53 -40.92 98.29 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 110.755 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.543 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.11 -39.23 89.2 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.484 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.588 ' O ' HG22 ' A' ' 107' ' ' ILE . 43.1 mm -62.58 -43.63 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.402 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -61.1 -48.2 82.76 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.788 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 mp -80.39 -21.26 42.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.588 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -62.53 -21.23 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-O 120.871 0.367 . . . . 0.0 111.082 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.1 m -62.78 -14.46 45.38 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.772 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.65 -26.26 64.31 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.551 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.276 179.319 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 120.4 0.143 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.6 m -69.13 119.73 13.87 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.62 176.52 7.19 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.454 178.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.94 -58.03 3.36 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -72.66 -35.69 67.77 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.536 0.684 . . . . 0.0 110.813 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -112.25 70.56 0.72 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.849 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.406 ' CG ' ' HZ1' ' A' ' 84' ' ' LYS . 98.5 mt -48.09 158.03 0.6 Allowed Pre-proline 0 CA--C 1.538 0.486 0 O-C-N 123.802 0.689 . . . . 0.0 111.589 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -38.77 165.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 124.987 3.792 . . . . 0.0 114.622 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.425 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 70.4 Cg_exo -50.29 -9.34 0.17 Allowed 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 123.874 3.049 . . . . 0.0 114.812 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.19 -36.15 68.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.575 0.171 . . . . 0.0 110.546 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.436 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 4.4 tp -108.25 -78.93 0.58 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.17 -0.612 . . . . 0.0 112.562 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.34 -48.6 80.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.427 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -59.8 -52.35 53.5 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.525 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -72.37 -43.4 64.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.5 -38.55 84.49 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -77.09 -33.0 57.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.101 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.57 -56.8 3.33 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.1 t -64.25 -45.07 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -177.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -73.45 -17.62 61.22 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.152 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.6 t70 -59.41 -37.09 77.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 0.0 110.671 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.6 p -84.85 4.58 32.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.499 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 53.9 t -61.91 141.33 58.06 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.329 0.585 . . . . 0.0 112.005 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -132.36 45.94 2.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.89 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.86 -12.01 70.03 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.282 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.67 98.67 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.451 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.14 -23.49 8.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.018 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.499 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.73 109.86 0.25 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.957 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.429 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 8.2 p90 -53.06 -47.89 68.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.168 0.484 . . . . 0.0 110.532 178.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -83.34 2.3 36.94 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.02 -37.41 71.07 Favored Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.03 -177.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.19 -45.22 15.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.65 0.262 . . . . 0.0 110.832 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.597 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -61.84 -38.07 86.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.717 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.78 -43.4 94.39 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.157 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.379 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.187 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.041 0.448 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -74.39 -25.99 59.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.661 179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.494 ' O ' ' HB3' ' A' ' 72' ' ' SER . 83.1 mt -59.81 -43.71 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 109.975 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.573 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.8 mt-10 -67.85 -36.15 79.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.135 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.81 -49.07 76.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.99 -4.04 57.66 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.573 HG11 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -56.67 -33.9 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 118.239 0.472 . . . . 0.0 111.12 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.54 -4.24 57.98 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.847 0.356 . . . . 0.0 110.733 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -106.15 21.99 16.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.015 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.56 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.29 21.74 9.18 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.269 -0.967 . . . . 0.0 114.281 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 94.37 141.83 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.36 1.064 . . . . 0.0 112.175 177.342 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.545 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.3 t -132.31 -29.9 1.56 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.078 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.597 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.58 -54.15 40.15 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 119.865 -1.159 . . . . 0.0 112.269 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.494 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -91.5 -43.4 9.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.149 0.499 . . . . 0.0 111.872 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.441 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.4 ttt180 -60.13 -47.58 85.33 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.548 -177.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.545 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.7 tt0 -62.59 -41.13 98.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.754 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.19 -46.59 89.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.686 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.61 -38.95 70.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.148 0.499 . . . . 0.0 111.014 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -75.32 -6.26 48.97 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -58.24 -40.35 81.5 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -86.77 -89.96 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.792 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -112.36 -55.79 2.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.436 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 20.3 ttpp -132.74 -44.58 0.89 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.604 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.3 t30 47.66 35.87 4.94 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.941 178.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 167.9 21.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.8 p -117.51 157.58 26.04 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.396 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.42 -39.44 79.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.431 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.47 99.27 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 120.902 -0.665 . . . . 0.0 112.981 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.04 -40.84 97.21 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 0.2 OUTLIER -81.79 -24.34 36.0 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.128 -179.715 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.66 -41.94 91.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.14 -41.33 98.15 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.445 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -66.73 -41.85 88.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.216 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 93.2 mt -61.62 -40.88 96.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.844 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -65.03 -39.59 93.57 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.527 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -61.81 -48.83 78.84 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.44 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 15.3 tpt -72.53 -39.82 67.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.8 40.35 2.02 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.987 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . 0.462 ' O ' HG12 ' A' ' 104' ' ' ILE . 77.4 m80 -78.38 87.68 4.4 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.718 0.294 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.64 -42.85 99.83 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -63.45 -41.08 98.64 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.125 0.488 . . . . 0.0 110.913 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.09 -38.12 85.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.646 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 107' ' ' ILE . 40.3 mm -61.29 -44.19 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.674 179.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -64.7 -41.21 96.17 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.621 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.35 -23.04 43.65 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.607 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.2 tp -63.87 -21.14 28.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.92 0.391 . . . . 0.0 111.425 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -75.48 -9.46 58.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.75 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -89.21 5.05 46.54 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 60.2 t80 . . . . . 0 N--CA 1.466 0.362 0 CA-C-O 120.63 0.252 . . . . 0.0 111.141 178.841 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.503 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 79.7 m80 . . . . . 0 C--O 1.223 -0.293 0 N-CA-C 111.69 0.255 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.7 m -77.74 120.07 22.13 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.59 170.51 21.33 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.029 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.6 -50.4 69.56 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -91.53 -35.0 14.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.363 0.602 . . . . 0.0 111.319 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.434 ' HA ' ' HZ2' ' A' ' 84' ' ' LYS . 1.2 p-10 -103.57 71.58 1.09 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.879 178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.9 mt -44.7 156.95 0.33 Allowed Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.935 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -39.33 164.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 124.999 3.799 . . . . 0.0 114.488 -178.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' A' ' 19' ' ' HIS . 9.6 Cg_endo -54.65 -7.72 0.98 Allowed 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.643 2.895 . . . . 0.0 113.973 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.43 -35.53 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.542 ' HB3' ' CE ' ' A' ' 84' ' ' LYS . 2.9 tp -105.7 -78.07 0.58 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.044 178.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.412 ' HB2' ' HZ3' ' A' ' 84' ' ' LYS . 61.7 tp -63.08 -46.04 89.31 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 35' ' ' ALA . . . -60.01 -54.32 38.39 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.633 -0.794 . . . . 0.0 114.797 -177.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.7 tm-20 -73.2 -42.81 62.25 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 95.9 mt -67.6 -37.89 83.2 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 13.7 p -78.98 -32.48 45.27 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.883 -179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 31' ' ' GLY . . . -85.31 -55.62 3.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.93 -44.58 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 80.9 mt -72.62 -19.27 61.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.249 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.605 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.2 t0 -60.49 -36.81 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.88 0.371 . . . . 0.0 110.829 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.1 m -86.01 5.14 34.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.108 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.506 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 52.0 t -65.33 141.94 58.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.291 0.567 . . . . 0.0 111.629 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -130.0 43.72 3.08 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.891 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.06 -12.5 69.07 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.402 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.3 97.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.037 0.418 . . . . 0.0 111.4 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.75 -23.38 10.65 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.649 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.506 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 78.41 109.9 0.19 Allowed Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.738 -178.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -52.73 -48.61 66.58 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 117.315 0.558 . . . . 0.0 110.674 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -83.74 1.28 43.49 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.576 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.67 -43.18 94.5 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.086 -178.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.2 mt -80.41 -41.58 24.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.029 0.415 . . . . 0.0 111.088 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.64 -41.68 98.21 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -60.18 -46.2 90.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.303 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 . . . . . 0 N--CA 1.463 0.194 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.943 179.443 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.608 0.242 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.561 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 8.3 p-80 -78.5 -20.08 51.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.446 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.546 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -62.23 -42.22 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.461 0.648 . . . . 0.0 110.068 178.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.609 ' O ' HG13 ' A' ' 67' ' ' VAL . 80.0 mm-40 -69.54 -33.4 72.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.756 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.3 mttt -62.86 -48.3 79.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.566 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 57.3 mm-40 -89.81 -4.33 57.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.668 -0.645 . . . . 0.0 112.739 -178.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.609 HG13 ' O ' ' A' ' 64' ' ' GLU . 4.3 p -57.38 -33.3 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.161 0.437 . . . . 0.0 111.173 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.27 -4.63 58.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.939 0.4 . . . . 0.0 110.571 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -107.13 22.45 15.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.059 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.612 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.65 13.4 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.257 -0.973 . . . . 0.0 114.595 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 102.21 144.67 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.858 1.263 . . . . 0.0 111.916 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . 0.605 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.9 t -130.7 -31.61 1.75 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.195 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.501 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.21 -63.35 5.25 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.841 -1.171 . . . . 0.0 111.546 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.446 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -89.08 -39.91 13.31 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . 0.441 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 59.1 ttt85 -62.37 -48.7 78.59 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.605 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.1 tp10 -63.43 -39.71 95.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 tp -61.05 -45.98 92.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.28 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 83.9 mt -69.51 -39.32 77.64 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.945 0.402 . . . . 0.0 110.979 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -77.01 -5.78 50.06 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.8 m -58.53 -40.15 82.15 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -86.42 -89.66 0.11 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.735 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.7 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -114.37 -55.01 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.542 ' CE ' ' HB3' ' A' ' 29' ' ' LEU . 1.2 ttmp? -132.05 -44.66 0.95 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 175.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 46.03 36.88 3.3 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.918 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 161.91 36.1 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.0 p -115.33 155.2 27.77 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.4 mp -60.56 -38.52 78.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.12 -179.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.47 -39.83 97.84 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.581 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.32 -45.3 91.95 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.636 0.255 . . . . 0.0 111.644 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.501 ' O ' HD12 ' A' ' 95' ' ' LEU . 0.4 OUTLIER -72.51 -26.0 61.61 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.832 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 53.6 mt -59.54 -38.22 80.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -61.79 -42.17 98.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.037 0.446 . . . . 0.0 109.998 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 91.1 t -70.72 -41.22 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.352 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 91' ' ' LEU . 4.5 mp -59.01 -38.7 79.84 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.612 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.51 -40.24 96.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.867 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.53 -41.99 92.47 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.4 tpt -70.99 -38.73 72.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.419 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.0 30.19 35.7 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.177 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -79.36 107.43 12.11 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.044 0.449 . . . . 0.0 110.649 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.95 -41.45 95.48 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -61.33 -40.52 94.53 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.234 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.99 -39.74 90.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.5 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.59 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -63.12 -43.89 99.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.014 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -64.48 -41.42 96.5 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.407 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 0.5 OUTLIER -80.87 -22.04 40.18 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.59 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.8 tp -62.04 -20.36 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 70.3 p -72.07 -11.26 60.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.639 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -83.49 15.98 2.82 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.887 0.375 . . . . 0.0 111.471 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' TYR . . . . . 0.482 ' CD1' HD12 ' A' ' 88' ' ' ILE . 63.4 t80 . . . . . 0 C--N 1.331 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 110.814 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.99 0.424 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -73.37 137.9 44.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.785 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 58.56 33.24 22.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.758 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.1 -177.81 49.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.403 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.5 m -117.57 139.62 50.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.733 0.301 . . . . 0.0 110.7 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.408 ' HG3' ' OE1' ' A' ' 69' ' ' GLN . 22.8 ptp -157.39 163.98 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.439 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -128.12 144.9 51.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.35 . . . . 0.0 111.593 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 152.08 54.79 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.033 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.3 114.69 28.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.539 0.209 . . . . 0.0 111.387 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 30.1 p -149.42 162.27 40.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.696 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 177.52 179.89 47.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 121.108 -0.567 . . . . 0.0 111.801 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.08 145.41 28.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.968 0.384 . . . . 0.0 111.394 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 ttp180 -159.12 146.66 17.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -175.13 -175.87 42.94 Favored Glycine 0 N--CA 1.454 -0.137 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.724 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.89 93.21 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 121.023 0.44 . . . . 0.0 111.113 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.66 139.89 30.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -84.59 109.16 17.76 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.202 0.525 . . . . 0.0 111.467 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.86 -7.92 50.91 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.723 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -103.82 21.84 15.57 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.228 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.3 m -75.02 113.5 12.42 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 20' ' ' THR . 20.5 mt -159.81 162.14 34.7 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.64 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.2 tp -63.87 -50.04 70.39 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -81.62 -35.77 29.69 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.291 0.567 . . . . 0.0 111.792 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -112.56 71.01 0.73 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.679 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.412 ' CG ' ' HZ3' ' A' ' 84' ' ' LYS . 95.5 mt -44.68 156.92 0.33 Allowed Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 124.009 0.818 . . . . 0.0 111.955 -179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -39.03 165.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 125.09 3.86 . . . . 0.0 114.849 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -50.06 -8.95 0.14 Allowed 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 124.061 3.174 . . . . 0.0 114.906 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.92 -36.04 67.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.68 0.218 . . . . 0.0 110.673 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.445 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.7 tp -107.82 -78.65 0.58 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.529 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.87 -49.1 77.61 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.413 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -59.59 -51.6 58.11 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 120.405 -0.902 . . . . 0.0 114.535 -177.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.441 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.4 tm-20 -72.67 -43.77 62.68 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.35 -38.94 88.77 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.44 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.9 p -75.21 -31.95 61.05 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.032 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.27 -55.95 3.77 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.4 t -64.47 -45.21 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.03 -18.59 61.94 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.06 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.9 t70 -59.96 -38.07 81.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.987 0.422 . . . . 0.0 110.772 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -83.3 3.02 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.444 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.55 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 48.3 t -62.37 141.53 58.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.402 0.62 . . . . 0.0 112.186 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -133.33 46.37 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.642 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.56 -12.86 68.25 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.462 -0.79 . . . . 0.0 113.177 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.71 98.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.964 0.382 . . . . 0.0 111.549 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.464 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -115.29 -25.2 8.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.174 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.55 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 80.14 107.58 0.27 Allowed Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.002 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -53.32 -46.0 69.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 117.244 0.522 . . . . 0.0 111.078 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -82.97 1.69 38.54 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.872 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.32 -44.13 93.53 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.323 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -73.55 -43.77 59.1 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.182 0.491 . . . . 0.0 111.211 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.67 -39.51 93.81 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.62 -42.62 97.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.795 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -42.67 99.62 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.473 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.39 -39.95 81.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.72 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.2 m 59.36 52.09 6.2 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.139 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -63.83 -37.96 89.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.801 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -156.41 146.67 21.4 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.728 0.299 . . . . 0.0 110.641 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -70.56 -31.2 68.15 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.43 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.7 mt -88.78 0.5 56.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.548 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.411 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.0 t70 -61.3 -38.56 87.25 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.654 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.486 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 28.1 m -60.52 -27.47 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.37 -45.51 90.8 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.089 0.471 . . . . 0.0 110.698 179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.463 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -76.13 -21.54 56.49 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.507 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.524 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.4 mt -59.47 -42.22 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.093 0.473 . . . . 0.0 110.632 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.543 ' O ' HG11 ' A' ' 67' ' ' VAL . 16.5 mm-40 -66.51 -35.17 79.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.97 0.414 . . . . 0.0 110.946 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.463 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.8 mttt -63.02 -49.57 74.12 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -177.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.516 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 7.5 mt-10 -89.74 -2.95 58.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.543 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.5 p -54.51 -32.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 118.423 0.556 . . . . 0.0 111.432 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.12 -4.73 58.21 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.793 0.33 . . . . 0.0 111.007 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.408 ' OE1' ' HG3' ' A' ' 6' ' ' MET . 28.8 mm100 -106.48 22.47 15.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.105 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.621 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.92 19.22 12.15 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.101 -1.047 . . . . 0.0 114.131 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.621 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 96.5 142.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.337 1.055 . . . . 0.0 111.862 177.594 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.554 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.5 t -131.0 -26.42 2.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.388 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.554 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -56.58 -64.58 4.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.095 -1.05 . . . . 0.0 111.892 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.7 m -88.32 -38.48 15.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 111.694 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt-85 -60.37 -47.75 84.71 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -177.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.5 tt0 -63.21 -40.35 97.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.758 0.313 . . . . 0.0 110.866 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.0 tp -61.1 -46.45 90.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.65 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.2 mt -70.5 -38.58 74.34 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -75.7 -6.73 51.94 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.685 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.8 m -58.65 -40.13 82.57 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -86.26 -89.57 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.788 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.59 -86.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -114.13 -54.83 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.445 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 20.9 ttpp -132.66 -44.2 0.9 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.437 175.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.7 t30 47.76 35.78 5.04 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.753 0.821 . . . . 0.0 111.815 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.25 171.08 14.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.921 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -121.21 157.96 29.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.73 -39.09 78.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.69 -39.72 98.28 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.774 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.35 -45.52 90.82 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.54 -23.98 45.91 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.393 -179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.6 tp -59.36 -40.64 87.1 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.673 0.273 . . . . 0.0 110.724 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -62.24 -41.53 98.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.299 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -69.56 -41.11 80.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.0 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 4.2 mp -59.84 -41.12 90.68 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.826 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.61 -40.51 97.09 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.073 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.78 -46.18 89.21 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.823 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.3 mmm -70.09 -37.34 75.38 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.775 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.48 38.51 5.28 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.383 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.464 ' NE2' ' HB3' ' A' ' 44' ' ' LEU . 39.4 m170 -79.98 91.71 5.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.928 0.394 . . . . 0.0 110.631 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -62.9 -42.08 99.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.9 tpt85 -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 110.647 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.24 -38.91 88.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.731 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.604 ' O ' HG22 ' A' ' 107' ' ' ILE . 45.1 mm -62.78 -39.56 85.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.863 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -60.25 -48.0 83.61 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.222 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.441 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -80.71 -22.04 40.68 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -178.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 104' ' ' ILE . 3.1 tp -60.66 -20.66 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 120.871 0.367 . . . . 0.0 111.424 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -71.94 -12.22 61.15 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.609 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.25 -27.18 65.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.189 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -60.34 -47.63 85.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.891 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 102.47 154.95 25.4 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.924 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.81 7.0 21.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.679 0.276 . . . . 0.0 111.51 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.8 p -138.56 142.87 33.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.8 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mp 62.1 29.3 17.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.695 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 79.2 p -81.47 151.23 68.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.179 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.01 62.46 8.49 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.777 2.318 . . . . 0.0 112.598 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.9 m -127.47 147.13 50.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -127.29 146.24 50.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.472 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -63.14 -39.67 95.34 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.518 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 45.4 m 61.5 35.8 17.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.781 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -111.12 27.36 9.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.096 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -116.29 142.38 46.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.687 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -125.41 146.86 49.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.572 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.134 -1.37 . . . . 0.0 112.23 179.986 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.032 0.444 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -104.19 119.28 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -102.72 1.89 35.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.188 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 76.17 -159.13 50.15 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.403 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.4 m 57.73 42.1 24.14 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.699 0.4 . . . . 0.0 111.888 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 25.7 mmt -104.45 139.03 39.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.567 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.56 154.68 41.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.042 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.2 -8.97 77.19 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.923 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -87.84 75.7 8.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 0.0 110.604 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 30.7 p -157.75 168.14 28.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 96.11 164.76 33.78 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.922 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.65 148.27 30.89 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -62.82 -45.51 92.29 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.427 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.35 168.14 20.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.408 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.86 -39.96 94.39 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.857 0.361 . . . . 0.0 111.931 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -108.65 147.11 32.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.7 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 p -81.59 109.85 16.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.126 0.489 . . . . 0.0 111.212 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.29 -8.49 50.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.988 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -104.49 22.27 15.26 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.804 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.6 m -71.24 116.07 11.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.654 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.41 162.44 17.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.312 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -64.84 -50.46 66.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.02 -35.81 23.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.412 0.625 . . . . 0.0 111.408 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -110.11 70.67 0.73 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.146 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.9 mt -46.35 156.18 0.51 Allowed Pre-proline 0 N--CA 1.467 0.405 0 O-C-N 124.067 0.854 . . . . 0.0 111.69 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -38.83 165.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 124.98 3.787 . . . . 0.0 114.698 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.91 -8.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.2 3.266 . . . . 0.0 115.204 -178.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.3 -36.64 66.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.975 0.352 . . . . 0.0 110.39 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.5 tp -106.65 -78.33 0.58 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.5 -51.7 68.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -178.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.57 -51.26 60.13 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.639 -0.791 . . . . 0.0 114.826 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.49 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.3 tm-20 -70.88 -43.62 68.0 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -67.08 -38.8 86.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.3 p -72.19 -31.07 65.57 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.62 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.62 -55.49 3.96 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.53 -45.69 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -73.11 -19.16 61.2 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.377 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.7 t70 -60.11 -39.16 85.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.012 0.434 . . . . 0.0 111.098 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.9 m -90.22 9.12 29.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.971 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 t -68.02 143.82 55.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.205 0.526 . . . . 0.0 111.695 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.32 49.51 2.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.217 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.69 -12.57 69.21 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.561 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.71 98.73 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.16 0.505 . . . . 0.0 111.136 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.4 mt -119.44 -26.63 5.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.722 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.92 113.51 0.32 Allowed Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.894 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 9.6 p90 -53.29 -47.44 69.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.009 0.404 . . . . 0.0 110.473 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.9 ptt180 -84.29 1.11 46.39 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.917 177.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.69 -46.7 91.9 Favored Glycine 0 CA--C 1.517 0.199 0 C-N-CA 120.159 -1.02 . . . . 0.0 113.334 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.18 -42.61 59.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.017 0.408 . . . . 0.0 110.911 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.6 -40.43 96.91 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.37 -45.81 92.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.237 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -68.67 -40.5 80.11 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.842 0.353 . . . . 0.0 111.234 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.0 mt -67.65 -41.45 83.79 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.193 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -143.64 136.49 27.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.708 0.29 . . . . 0.0 110.66 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -112.91 118.82 35.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.865 0.364 . . . . 0.0 111.294 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.9 t -157.83 143.01 16.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.182 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -85.3 -15.32 43.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.477 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.48 -31.65 15.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.349 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.3 -38.38 90.95 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.306 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.407 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 35.9 m -62.66 -25.45 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.85 -45.87 90.58 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.313 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -74.69 -25.08 58.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.962 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.514 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.7 mt -59.88 -43.4 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 110.161 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.603 ' O ' HG11 ' A' ' 67' ' ' VAL . 99.1 mt-10 -66.99 -36.01 81.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.69 -49.08 76.52 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -90.18 -3.78 57.66 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.603 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.6 p -56.05 -34.41 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.271 0.487 . . . . 0.0 111.321 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.2 -4.21 58.31 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 110.813 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -105.67 21.93 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.751 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.04 21.42 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.362 -0.923 . . . . 0.0 114.276 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 94.91 141.56 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.319 1.047 . . . . 0.0 112.159 177.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.521 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.8 t -131.56 -29.89 1.71 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.42 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -53.02 -66.98 2.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.356 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.9 m -87.38 -36.71 17.62 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 122.625 -0.338 . . . . 0.0 111.525 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -60.77 -47.16 87.58 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.521 ' HB3' ' O ' ' A' ' 72' ' ' SER . 81.7 tt0 -62.11 -42.4 99.19 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.17 -45.62 90.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.291 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.3 mt -67.6 -40.21 84.77 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.843 0.354 . . . . 0.0 111.285 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -81.5 -5.85 58.37 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.6 t -58.99 -41.35 87.44 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.9 m95 -85.4 -89.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.796 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.53 -87.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -114.47 -54.29 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.414 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 16.0 ttpp -132.3 -43.51 0.94 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.4 t30 48.25 34.19 4.31 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.791 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.51 170.83 15.2 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.789 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 63.2 p -126.45 159.13 34.21 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.375 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.7 mp -59.7 -40.03 81.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.407 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.0 -39.49 97.14 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.546 179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -63.82 -44.23 93.85 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.461 ' O ' HG22 ' A' ' 94' ' ' VAL . 0.8 OUTLIER -73.85 -27.58 61.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.736 -179.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.6 mt -60.28 -32.83 71.56 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.542 0.21 . . . . 0.0 111.442 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -61.03 -42.52 98.63 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.479 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.461 HG22 ' O ' ' A' ' 91' ' ' LEU . 15.7 m -86.3 -23.21 6.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.411 179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 91' ' ' LEU . 1.8 mp -61.9 -43.25 99.24 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.833 0.349 . . . . 0.0 110.255 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -65.72 -39.95 91.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.739 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -64.21 -43.84 93.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.03 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -71.75 -39.13 70.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.595 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.24 33.36 6.0 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.551 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.562 ' CG ' ' HB3' ' A' ' 103' ' ' ALA . 2.3 t-80 -75.92 86.28 2.86 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.065 0.459 . . . . 0.0 111.35 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.84 -41.21 95.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.549 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.24 -39.86 94.82 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.487 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.562 ' HB3' ' CG ' ' A' ' 100' ' ' HIS . . . -60.71 -38.81 86.3 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.731 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.586 ' O ' HG21 ' A' ' 107' ' ' ILE . 97.1 mt -61.47 -43.67 97.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.278 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -61.48 -47.66 84.67 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.245 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.49 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -77.88 -22.46 49.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -179.149 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.586 HG21 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -63.32 -19.99 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.773 0.321 . . . . 0.0 111.478 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.2 p -67.84 -12.84 61.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.429 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -69.83 -27.45 64.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.52 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -70.61 129.39 39.05 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.91 139.89 17.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.494 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -84.36 -0.06 51.18 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.1 -44.28 98.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.02 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.4 mt -110.49 132.29 54.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.806 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.4 m -125.82 90.23 50.82 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.45 65.77 7.29 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.58 2.186 . . . . 0.0 112.895 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.3 p -63.99 -34.16 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 58.42 42.01 21.96 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.647 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -62.33 -39.41 92.97 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.3 m 60.64 -148.92 0.43 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.636 0.585 . . . . 0.0 111.381 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 58.65 33.91 23.43 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.419 0.449 . . . . 0.0 111.857 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -86.17 144.01 27.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.645 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 57.9 39.62 26.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.51 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.223 -1.32 . . . . 0.0 112.332 -179.979 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.659 0.266 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 60.66 40.55 16.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.815 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -113.15 148.57 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.874 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.26 174.15 36.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.811 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.413 ' HA ' ' OD1' ' A' ' 41' ' ' ASP . 52.4 m -103.83 123.6 47.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.931 0.366 . . . . 0.0 111.044 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 78.8 mtm -136.69 157.42 46.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.589 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.79 153.81 48.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.591 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -129.64 156.76 21.53 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.58 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.8 p-10 -119.51 19.53 12.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.734 0.302 . . . . 0.0 111.382 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.8 m -101.26 129.89 47.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.942 0.401 . . . . 0.0 111.393 -179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.31 -175.35 39.0 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.346 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -133.27 147.0 51.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.807 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 125.06 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.986 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.77 8.78 19.25 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.188 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -117.65 -66.53 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.994 0.397 . . . . 0.0 111.772 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.3 mt -108.8 144.02 37.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.3 p -90.01 110.01 21.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.906 0.384 . . . . 0.0 111.3 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.19 -11.27 38.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 0.0 111.086 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -108.8 21.54 17.1 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.776 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t -74.43 125.37 28.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -178.44 4.99 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.492 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.05 -58.23 3.26 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -73.92 -35.73 64.64 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.554 0.692 . . . . 0.0 110.513 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -109.91 70.28 0.72 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.732 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -48.34 156.38 0.81 Allowed Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.987 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -34.93 163.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 125.086 3.857 . . . . 0.0 115.17 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.41 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 82.1 Cg_exo -49.24 -8.72 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 124.277 3.318 . . . . 0.0 115.054 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.62 -35.56 63.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.605 0.184 . . . . 0.0 110.904 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.6 tp -108.64 -79.19 0.58 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.3 tp -62.01 -47.75 83.37 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.41 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -60.63 -51.3 59.56 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.651 -0.785 . . . . 0.0 114.632 -177.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -70.5 -43.52 69.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.71 -38.44 86.74 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.967 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.8 p -73.25 -31.82 64.34 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.797 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.34 -54.49 4.56 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -178.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 71.5 t -64.54 -43.99 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.8 mt -71.09 -18.25 62.55 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.419 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 5.7 t70 -59.58 -37.81 79.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 0.0 110.661 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.1 m -86.75 7.39 26.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.527 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.9 t -65.54 140.01 58.52 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.345 0.593 . . . . 0.0 111.746 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' OD1' ' HA ' ' A' ' 5' ' ' SER . 24.3 t0 -131.42 44.06 2.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.454 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.59 -10.91 72.21 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.392 -0.822 . . . . 0.0 113.017 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.19 97.71 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.905 0.352 . . . . 0.0 111.562 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -116.24 -22.19 8.98 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.527 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.53 113.72 0.25 Allowed Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.764 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -52.37 -49.2 64.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.284 0.542 . . . . 0.0 109.925 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -83.93 1.38 43.73 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.562 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.62 92.33 Favored Glycine 0 CA--C 1.516 0.129 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.437 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.7 -43.32 59.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 0.0 111.223 179.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.53 -39.9 94.63 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -59.69 -45.05 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.383 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -65.48 -40.01 92.61 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.745 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.09 -43.87 70.22 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.734 0.302 . . . . 0.0 110.968 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m -139.0 117.68 12.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 0.0 110.861 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.3 m -105.9 90.24 3.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.664 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.3 m -133.53 149.74 51.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.2 p90 -86.37 168.36 13.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.445 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp 73.25 -40.83 0.48 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.428 0.691 . . . . 0.0 111.768 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.42 -24.43 67.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.587 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 22.5 m -63.46 -21.87 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.904 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -64.3 -42.14 96.51 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 110.576 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -68.84 -26.36 65.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.023 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.636 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.9 mt -59.67 -38.99 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.183 0.516 . . . . 0.0 110.455 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.554 ' O ' HG11 ' A' ' 67' ' ' VAL . 80.4 mm-40 -79.66 -21.24 45.01 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.106 -0.371 . . . . 0.0 111.193 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.17 -45.41 60.53 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.605 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.3 mt-10 -87.97 -4.72 58.78 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.554 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.8 p -58.56 -28.55 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.236 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -74.73 -14.75 60.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -95.66 9.06 41.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.917 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 71' ' ' LYS . . . 104.22 -7.2 47.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 118.33 -1.261 . . . . 0.0 114.866 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 2.0 tppt? 158.58 139.1 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.263 1.032 . . . . 0.0 112.088 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.636 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.0 t -134.27 -24.17 1.64 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.46 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.485 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -57.23 -67.43 2.22 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.97 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.3 m -88.62 -35.12 17.03 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.569 -0.371 . . . . 0.0 111.482 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.456 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 74.0 ttt180 -60.75 -46.35 90.78 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.731 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.509 ' HB3' ' O ' ' A' ' 72' ' ' SER . 80.7 tt0 -60.54 -44.27 96.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 110.52 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.1 tp -62.54 -47.82 82.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.253 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.446 HD21 ' HD2' ' A' ' 86' ' ' LYS . 85.3 mt -65.16 -39.81 93.45 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.53 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -81.0 -5.75 57.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.8 m -59.34 -39.84 84.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 65.8 m95 -86.27 -89.97 0.11 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.278 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.82 -87.07 0.49 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.134 0.492 . . . . 0.0 110.053 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -112.62 -56.75 2.37 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' A' ' 86' ' ' LYS . 13.6 ttpp -131.95 -43.57 0.98 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.564 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.6 t30 49.73 28.93 2.89 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.975 -1.012 . . . . 0.0 112.91 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.508 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 37.8 mttp -135.51 134.17 39.22 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 44.5 p -83.82 161.19 21.01 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.61 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.06 -40.33 82.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.143 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.36 -40.21 98.66 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.49 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -63.46 -48.59 77.08 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.562 ' O ' HD13 ' A' ' 95' ' ' LEU . 0.1 OUTLIER -75.98 -24.11 55.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.862 -179.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.82 -39.38 81.01 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.425 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.88 -41.16 95.43 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.868 0.366 . . . . 0.0 110.452 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.7 -40.71 84.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 121.224 0.535 . . . . 0.0 109.729 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.562 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -60.31 -39.92 88.72 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.613 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.39 -40.02 96.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.812 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -63.94 -41.67 97.55 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.731 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.0 tpt -70.05 -38.84 75.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.086 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.29 29.77 11.92 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.721 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.22 99.47 4.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.924 0.392 . . . . 0.0 111.06 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.58 -41.83 96.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.669 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -62.31 -41.39 98.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.125 0.488 . . . . 0.0 110.805 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.89 -39.88 90.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.701 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.552 ' O ' HG22 ' A' ' 107' ' ' ILE . 42.0 mm -62.66 -45.21 99.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -66.51 -40.76 89.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.3 tp -83.89 -21.79 31.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.552 HG22 ' O ' ' A' ' 104' ' ' ILE . 10.2 tt -65.79 -20.22 26.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.927 0.394 . . . . 0.0 111.321 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.0 p -70.05 -9.93 57.0 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.814 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.41 -17.62 63.02 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -60.29 -47.95 83.83 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.779 0.323 . . . . 0.0 110.352 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 63.64 -125.79 33.85 Favored Glycine 0 C--N 1.332 0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 113.659 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.03 145.78 55.88 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.022 0.439 . . . . 0.0 112.107 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.0 m -78.57 154.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.247 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.5 mt -109.23 133.16 53.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.855 0.359 . . . . 0.0 111.031 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 53.4 m -82.77 131.18 55.37 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.717 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.51 139.21 89.47 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.736 2.291 . . . . 0.0 112.549 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 81.2 p -70.17 -30.42 67.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.855 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.82 149.0 50.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.807 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -63.97 -39.74 94.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.368 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 57.8 m -133.16 149.41 52.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.186 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.39 152.3 47.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.424 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -142.02 157.92 44.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.366 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -124.85 145.62 49.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.577 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.505 -1.164 . . . . 0.0 112.157 -179.96 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 121.063 0.459 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -120.86 143.01 49.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.738 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.87 149.89 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.588 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.92 174.02 39.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.997 -0.62 . . . . 0.0 111.961 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.7 m -112.47 118.3 34.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.849 0.324 . . . . 0.0 110.94 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm -119.46 11.65 12.19 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.974 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 65.14 -163.77 0.25 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.623 0.577 . . . . 0.0 111.37 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.89 -174.71 47.26 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.139 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -97.63 173.18 7.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.867 0.365 . . . . 0.0 110.784 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -119.24 154.18 33.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.125 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -159.42 175.94 36.26 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.064 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.42 146.6 50.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.702 0.287 . . . . 0.0 111.09 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.6 ttp-105 -120.11 126.65 51.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.022 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.27 155.29 34.22 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.99 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.59 97.79 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.889 0.376 . . . . 0.0 111.373 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.8 mt -83.39 144.9 29.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.816 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.0 p -80.9 108.33 14.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.723 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.87 -10.02 38.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.384 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -106.4 21.51 17.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.073 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.9 t -81.64 113.58 19.75 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.453 HD11 ' OD2' ' A' ' 24' ' ' ASP . 24.7 mt -153.36 167.09 30.57 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.836 178.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.13 -50.19 71.42 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -81.8 -35.58 29.36 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.493 0.663 . . . . 0.0 111.348 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.453 ' OD2' HD11 ' A' ' 21' ' ' LEU . 1.8 p-10 -112.42 71.85 0.76 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.009 179.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.435 HD12 ' CE1' ' A' ' 110' ' ' TYR . 91.6 mt -44.53 155.45 0.37 Allowed Pre-proline 0 CA--C 1.538 0.515 0 O-C-N 123.978 0.798 . . . . 0.0 111.22 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -38.69 165.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 124.846 3.697 . . . . 0.0 114.794 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -49.05 -8.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 124.01 3.14 . . . . 0.0 114.99 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.76 -35.79 64.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.741 0.246 . . . . 0.0 110.657 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.4 tp -108.38 -78.64 0.59 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.4 tp -61.39 -48.65 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -51.1 60.73 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.595 -0.812 . . . . 0.0 114.494 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -70.79 -43.0 69.59 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.9 -38.68 86.73 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.842 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.646 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -73.25 -30.52 63.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.656 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.81 -55.45 3.96 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.72 -45.64 96.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.7 mt -71.62 -21.01 61.9 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.12 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.646 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.8 t0 -61.55 -38.65 88.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.039 0.447 . . . . 0.0 110.503 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.4 p -85.2 1.54 47.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.107 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.553 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.6 t -64.22 141.33 58.81 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.297 0.57 . . . . 0.0 111.663 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.91 39.04 3.85 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.926 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.18 -16.73 57.89 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.06 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.06 99.34 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.971 0.415 . . . . 0.0 111.816 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.423 ' O ' ' HE2' ' A' ' 98' ' ' MET . 81.8 mt -108.89 -21.56 12.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.183 179.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.553 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 76.11 107.05 0.12 Allowed Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.563 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.2 p90 -52.88 -50.81 63.12 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 117.313 0.557 . . . . 0.0 110.349 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.77 -0.04 52.37 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.095 177.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.42 95.57 Favored Glycine 0 C--O 1.23 -0.115 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.023 -177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.0 mt -81.79 -42.4 19.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.735 0.303 . . . . 0.0 111.215 179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.45 -41.73 96.37 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -61.48 -41.26 96.98 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.115 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -64.22 -40.0 95.15 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.76 0.314 . . . . 0.0 111.203 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.7 tt -70.07 -46.96 63.84 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.842 -179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 68.8 m -148.8 150.38 32.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.838 0.351 . . . . 0.0 111.511 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.481 ' OG ' ' HA3' ' A' ' 124' ' ' GLY . 80.0 p -136.75 141.49 43.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.53 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -151.13 161.79 42.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.172 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -74.1 134.64 42.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.615 0.245 . . . . 0.0 110.729 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp 63.15 14.83 8.03 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.08 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.57 -40.03 94.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.886 0.374 . . . . 0.0 111.523 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.1 m -64.93 -19.98 26.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -60.97 -46.95 88.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.637 0.256 . . . . 0.0 110.404 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -72.66 -29.5 63.49 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.216 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.541 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.7 mt -60.23 -43.11 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.615 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.1 mm-40 -67.64 -35.93 79.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.238 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.2 -48.61 79.24 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.522 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -89.95 -3.47 58.01 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.615 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -55.85 -34.04 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 118.202 0.455 . . . . 0.0 111.432 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.22 -4.77 58.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.935 0.397 . . . . 0.0 110.853 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.48 21.81 16.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.818 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.584 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.13 21.22 9.65 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.311 -0.947 . . . . 0.0 114.22 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.584 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 94.18 141.77 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.281 1.032 . . . . 0.0 112.248 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.548 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 4.1 t -129.99 -30.38 2.01 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.998 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.35 -66.07 3.05 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.022 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.44 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.02 -35.6 18.69 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.4 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.7 ttt180 -62.69 -47.22 84.6 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.548 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -62.34 -41.33 98.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.615 0.245 . . . . 0.0 111.152 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.9 tp -61.07 -47.22 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.979 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.2 mt -71.46 -39.4 70.98 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.069 0.462 . . . . 0.0 111.673 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -76.62 -7.26 54.9 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -58.43 -38.59 77.75 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -87.58 -90.57 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.676 -0.409 . . . . 0.0 110.928 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.405 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . . . -108.44 -86.81 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 82' ' ' ALA . 22.1 mp0 -110.96 -56.89 2.31 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -132.62 -43.49 0.91 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.419 176.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.4 36.21 6.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.718 0.807 . . . . 0.0 111.788 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.99 171.05 14.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.485 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -121.21 157.4 30.34 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.324 179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -39.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.374 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.97 -39.45 98.08 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.862 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -63.23 -45.67 90.53 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.571 ' O ' HD13 ' A' ' 95' ' ' LEU . 0.2 OUTLIER -77.49 -24.6 50.1 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.658 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.8 tp -58.97 -41.74 88.24 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.176 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.94 -41.81 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.087 0.47 . . . . 0.0 110.471 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.0 t -68.3 -42.06 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.431 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.571 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.0 mp -60.28 -40.17 89.47 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.004 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.1 -39.21 93.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.495 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -62.61 -45.33 93.34 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.476 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.423 ' HE2' ' O ' ' A' ' 44' ' ' LEU . 14.5 tpt -72.61 -39.41 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.257 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.37 39.55 3.44 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.472 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.49 ' ND1' ' HB3' ' A' ' 103' ' ' ALA . 13.3 t-160 -80.47 95.23 6.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.177 0.513 . . . . 0.0 110.546 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.89 -42.3 94.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -62.77 -39.38 94.0 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.855 0.36 . . . . 0.0 111.695 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.49 ' HB3' ' ND1' ' A' ' 100' ' ' HIS . . . -60.54 -38.7 85.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.279 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.446 ' O ' HG21 ' A' ' 107' ' ' ILE . 95.9 mt -60.93 -43.27 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.035 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -62.96 -42.08 99.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.03 -31.13 25.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.446 HG21 ' O ' ' A' ' 104' ' ' ILE . 9.0 tt -62.3 -24.49 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.18 0.514 . . . . 0.0 110.47 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.407 ' O ' HG23 ' A' ' 108' ' ' THR . 85.1 m -64.88 -26.13 68.19 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.076 178.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -67.92 -20.44 65.09 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.435 ' CE1' HD12 ' A' ' 25' ' ' LEU . 81.0 t80 -60.02 -48.93 79.67 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 178.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 58.23 -131.4 52.03 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.395 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . 65.89 164.39 0.17 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.444 0.698 . . . . 0.0 112.448 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 17.3 m -116.74 -10.19 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.914 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.5 tp -131.87 130.71 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.181 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.6 p -129.42 151.3 77.67 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.81 158.61 55.11 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.638 2.225 . . . . 0.0 112.499 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 63.0 m -109.36 146.27 34.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.885 0.374 . . . . 0.0 110.929 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -126.28 162.01 26.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.61 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -68.89 149.17 49.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.152 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 87.5 p -70.89 160.58 32.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.485 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -146.48 162.02 39.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.389 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -105.06 126.67 52.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.547 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -79.21 147.84 32.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . 0.481 ' HA3' ' OG ' ' A' ' 55' ' ' SER . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.473 -1.182 . . . . 0.0 112.512 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.09 0.471 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -122.4 141.43 51.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.538 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.89 149.32 50.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.634 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.12 172.23 39.88 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.998 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 97.8 p -153.16 161.89 41.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.544 0.172 . . . . 0.0 110.699 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 95.6 mmm 61.34 -131.08 0.72 Allowed 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.738 0.649 . . . . 0.0 110.803 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 56.22 61.46 2.72 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.289 0.368 . . . . 0.0 111.552 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -168.98 -175.47 38.37 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.427 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -145.1 174.83 10.71 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -99.03 130.95 45.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.913 0.387 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.11 -174.62 28.96 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.138 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.89 149.24 31.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.799 0.299 . . . . 0.0 111.41 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.8 -161.57 0.85 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.824 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.89 65.19 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.221 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.66 -165.98 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.782 -0.246 . . . . 0.0 110.979 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.0 mt -67.8 152.47 45.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.05 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -66.65 107.35 2.09 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 121.214 0.53 . . . . 0.0 111.433 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.52 -8.25 45.01 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.286 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -102.63 20.57 16.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.264 -178.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -72.61 115.08 11.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.794 0.33 . . . . 0.0 111.886 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 24' ' ' ASP . 23.8 tp -152.85 163.24 40.12 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.94 -47.63 85.54 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -90.87 -35.83 14.54 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.425 0.631 . . . . 0.0 110.555 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.519 ' HB2' ' HB2' ' A' ' 83' ' ' GLN . 49.2 t0 -94.03 74.91 4.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.737 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.4 HD12 ' CE1' ' A' ' 110' ' ' TYR . 82.5 mt -47.37 154.21 0.86 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.357 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -38.61 166.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 124.82 3.68 . . . . 0.0 114.894 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.78 -9.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 124.312 3.341 . . . . 0.0 115.545 -178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.04 -34.82 63.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.087 0.403 . . . . 0.0 109.987 179.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.441 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.6 tp -107.79 -77.88 0.59 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.7 -52.03 65.95 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -178.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.44 -50.57 66.32 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.343 -0.932 . . . . 0.0 114.82 -177.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' OE2' HG21 ' A' ' 36' ' ' VAL . 43.2 tp10 -68.84 -43.74 74.87 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.417 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 97.1 mt -68.23 -39.19 82.4 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 120.69 -0.404 . . . . 0.0 112.054 -179.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.669 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.0 p -71.6 -27.99 63.5 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.357 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.72 -57.54 3.01 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.486 HG21 ' OE2' ' A' ' 32' ' ' GLU . 55.6 t -64.36 -45.26 96.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.419 HD22 ' NE2' ' A' ' 100' ' ' HIS . 97.6 mt -70.69 -22.49 62.46 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.669 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.6 t0 -61.11 -36.5 79.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.981 0.42 . . . . 0.0 110.872 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.3 m -88.06 11.45 16.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.119 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.504 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 46.2 t -62.16 143.24 57.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.564 0.697 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -131.9 36.97 3.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.393 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.64 -13.96 66.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.925 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.84 96.29 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.56 -25.5 9.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.11 0.481 . . . . 0.0 110.561 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.504 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 77.22 109.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.184 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.1 p90 -52.7 -49.85 64.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.377 0.588 . . . . 0.0 110.625 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.5 ptt180 -83.91 -0.38 51.15 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.485 177.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.43 -45.96 93.7 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.704 -177.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 90.6 mt -74.86 -44.14 50.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.213 0.53 . . . . 0.0 111.17 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -39.91 94.5 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.0 tp10 -59.23 -44.45 92.31 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.522 0.514 . . . . 0.0 111.371 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 mtt85 -65.5 -41.01 93.68 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.708 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.5 tp -70.47 -44.6 67.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.531 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.3 m -144.11 139.65 28.99 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.689 0.28 . . . . 0.0 111.212 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.0 m -123.85 126.53 46.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.734 0.302 . . . . 0.0 110.928 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -159.26 139.41 12.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.51 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.532 ' O ' HG23 ' A' ' 60' ' ' VAL . 85.5 m95 -66.79 -39.48 87.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.32 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.95 -39.06 87.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.943 0.402 . . . . 0.0 110.851 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.469 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.4 t70 -63.23 -44.18 95.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.767 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 57' ' ' TRP . 27.1 m -64.47 -30.35 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -63.31 -41.12 98.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 0.0 110.652 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -77.17 -22.33 52.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.174 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.585 ' O ' HG12 ' A' ' 67' ' ' VAL . 78.9 mt -60.2 -42.62 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.9 0.381 . . . . 0.0 110.835 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.527 ' O ' HG23 ' A' ' 67' ' ' VAL . 80.3 mm-40 -71.48 -20.99 62.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.531 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -72.11 -46.66 55.8 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.593 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 67.3 mm-40 -89.78 -2.98 58.37 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -177.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.585 HG12 ' O ' ' A' ' 63' ' ' ILE . 16.2 m -55.43 -32.22 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.95 0.795 . . . . 0.0 111.942 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -88.44 -5.63 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.471 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -107.97 18.21 21.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.602 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.51 23.5 7.92 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.113 -1.042 . . . . 0.0 114.934 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.602 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 95.3 143.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.249 1.02 . . . . 0.0 112.559 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.1 t -132.64 -32.13 1.31 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.301 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.31 -67.39 1.99 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.697 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.2 m -86.89 -36.35 18.46 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.652 0.263 . . . . 0.0 111.283 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.98 -47.98 83.94 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.498 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.4 tt0 -61.42 -43.18 99.32 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.575 0.226 . . . . 0.0 111.26 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.31 -45.46 93.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.115 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.4 -38.72 78.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.853 0.359 . . . . 0.0 111.356 179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 22.5 m95 -77.31 -5.87 51.12 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.7 m -59.1 -39.67 82.95 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -86.12 -89.95 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.987 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.39 -87.52 0.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 97.7 mm-40 -111.8 -53.95 2.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.455 ' HB3' ' HA ' ' A' ' 24' ' ' ASP . 23.5 ttpp -133.14 -43.88 0.86 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.938 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.8 t30 48.59 37.99 10.35 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.137 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 171.96 13.52 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.9 p -120.69 156.14 32.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.428 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.54 -38.62 78.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.106 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.58 -39.76 98.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.751 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.3 -45.73 90.03 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.49 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 0.2 OUTLIER -77.18 -24.72 51.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.382 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.83 -41.65 91.79 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.851 0.358 . . . . 0.0 110.85 -179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -62.55 -40.42 96.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.093 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.8 t -68.1 -40.07 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.11 178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 91.5 mt -61.09 -39.22 89.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.451 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -62.77 -39.33 93.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.568 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -62.37 -39.87 94.6 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.698 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -12.12 41.03 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.75 39.88 59.26 Favored Glycine 0 C--N 1.329 0.157 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.725 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.486 ' ND1' ' HB1' ' A' ' 103' ' ' ALA . 10.5 t-80 -70.75 93.43 0.95 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.113 0.483 . . . . 0.0 110.608 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.633 ' O ' HG23 ' A' ' 104' ' ' ILE . 82.9 mtt85 -64.5 -42.25 95.94 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -66.59 -39.43 88.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.486 ' HB1' ' ND1' ' A' ' 100' ' ' HIS . . . -60.78 -39.07 87.49 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.633 HG23 ' O ' ' A' ' 101' ' ' ARG . 8.5 tp -62.83 -31.87 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.44 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -70.57 -41.2 72.72 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.71 0.29 . . . . 0.0 111.228 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.29 -22.19 30.79 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.516 HG23 ' O ' ' A' ' 104' ' ' ILE . 2.8 tp -62.03 -20.49 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 120.93 0.395 . . . . 0.0 111.231 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.4 p -70.39 -12.54 61.65 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.663 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.87 -26.8 64.36 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.76 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.4 ' CE1' HD12 ' A' ' 25' ' ' LEU . 78.1 t80 -63.78 126.87 28.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.244 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -137.79 16.51 3.51 Favored Glycine 0 C--N 1.333 0.376 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.833 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -81.36 162.26 23.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.904 0.383 . . . . 0.0 111.172 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 26.9 m -119.83 164.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 93.1 mt -70.16 150.52 46.42 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.7 m 55.71 62.7 6.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -56.66 -37.16 98.3 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 123.178 2.585 . . . . 0.0 113.11 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.6 m -126.5 148.3 49.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -123.81 146.2 48.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -88.11 61.73 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.065 0.459 . . . . 0.0 110.539 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 80.2 p -96.77 -2.71 43.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -98.62 25.26 6.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.869 0.366 . . . . 0.0 111.578 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -63.3 -39.67 95.23 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.347 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -125.59 145.02 50.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.525 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.485 -1.175 . . . . 0.0 112.187 179.997 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 120.97 0.414 . . . . 0.0 110.855 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -126.71 148.4 49.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.634 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.377 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.73 -168.9 41.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.037 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.8 m 58.76 44.05 17.66 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.753 0.421 . . . . 0.0 111.75 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtm -75.4 143.89 42.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.82 157.69 43.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.7 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -71.66 154.08 50.96 Favored Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.628 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -154.72 167.86 28.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.51 -46.62 89.2 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.382 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 84.0 -172.34 49.54 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.539 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.84 138.93 52.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.667 0.27 . . . . 0.0 110.844 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -131.51 147.87 52.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.22 -145.58 12.74 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 121.037 -0.602 . . . . 0.0 111.65 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.86 -39.49 92.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.906 0.384 . . . . 0.0 110.932 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -95.39 132.9 39.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.982 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.404 ' O ' HG23 ' A' ' 20' ' ' THR . 9.5 p -85.77 110.38 19.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.827 0.346 . . . . 0.0 111.468 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.03 -10.7 41.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.397 0.618 . . . . 0.0 110.552 178.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -107.28 21.46 17.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.373 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 17' ' ' SER . 7.2 t -78.77 130.87 36.23 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -176.84 2.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.012 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mp -79.88 -57.62 3.56 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -72.92 -35.35 67.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.584 0.707 . . . . 0.0 110.7 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.27 71.1 0.73 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.165 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.428 HD11 ' CE1' ' A' ' 110' ' ' TYR . 95.4 mt -49.34 157.1 0.94 Allowed Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.077 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -37.28 163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 124.478 3.452 . . . . 0.0 115.009 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.404 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 88.7 Cg_exo -49.52 -9.09 0.12 Allowed 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 124.146 3.23 . . . . 0.0 114.95 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' CB ' ' HA ' ' A' ' 107' ' ' ILE . . . -55.19 -36.38 65.83 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 121.98 0.112 . . . . 0.0 110.995 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.419 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.02 -78.12 0.59 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.87 -47.6 84.25 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -60.79 -52.92 49.39 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.333 -0.937 . . . . 0.0 114.73 -177.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.94 -43.88 64.5 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.89 -39.44 87.46 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.3 p -73.97 -30.83 62.71 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 120.121 -0.632 . . . . 0.0 111.838 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.4 -56.32 3.58 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.64 -45.22 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -177.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.409 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 83.9 mt -74.51 -17.34 60.77 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.165 -0.334 . . . . 0.0 111.42 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.481 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 7.3 t70 -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.028 0.442 . . . . 0.0 110.976 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 59.1 m -88.85 10.79 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.53 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.0 t -67.49 145.2 55.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.087 0.47 . . . . 0.0 111.199 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.95 50.75 2.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.72 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.96 -12.73 69.32 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.9 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.58 98.79 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 117.285 0.542 . . . . 0.0 110.992 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -120.52 -30.49 4.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.329 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.31 118.08 1.04 Allowed Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.544 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.4 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 6.4 p90 -56.0 -43.03 77.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.057 0.428 . . . . 0.0 110.348 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 40.0 ptt180 -83.66 0.44 46.93 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.419 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.3 -50.2 63.77 Favored Glycine 0 CA--C 1.516 0.148 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.914 -177.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -71.99 -42.0 66.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.288 0.544 . . . . 0.0 111.496 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -65.58 -42.71 91.45 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.33 -45.76 92.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.286 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.405 ' NH2' ' HG2' ' A' ' 97' ' ' GLU . 99.7 mtt180 -70.22 -36.64 74.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.716 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 tt -66.85 -44.43 81.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.767 -0.197 . . . . 0.0 111.214 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.3 p -158.38 158.69 34.72 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 111.533 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 65.7 m -135.35 145.33 47.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.748 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.578 ' OG ' ' HB2' ' A' ' 59' ' ' ASP . 98.5 p -156.82 163.56 39.07 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.607 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 21.3 t90 -70.78 129.83 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.473 -179.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 85.6 mt 63.65 18.22 10.96 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.642 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.578 ' HB2' ' OG ' ' A' ' 56' ' ' SER . 37.4 t70 -64.05 -41.02 97.53 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.886 0.374 . . . . 0.0 111.513 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.8 m -67.7 -20.07 25.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -60.75 -47.92 84.15 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.762 0.315 . . . . 0.0 110.774 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.46 -28.15 61.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.559 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.497 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.8 mt -60.1 -44.05 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.331 0.586 . . . . 0.0 110.03 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.598 ' O ' HG13 ' A' ' 67' ' ' VAL . 98.7 mt-10 -66.78 -37.09 83.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.249 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.96 -46.71 86.44 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.521 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.0 mt-10 -89.78 -4.28 57.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.598 HG13 ' O ' ' A' ' 64' ' ' GLU . 5.4 p -56.87 -33.31 41.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 118.361 0.528 . . . . 0.0 111.141 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.87 -4.36 58.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.931 0.396 . . . . 0.0 110.842 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -106.58 21.61 17.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.84 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.638 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.94 21.56 9.5 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.233 -0.984 . . . . 0.0 114.282 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.638 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.1 OUTLIER 95.24 147.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.602 1.161 . . . . 0.0 111.667 177.687 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.521 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.3 t -134.8 -36.57 0.84 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.401 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -50.22 -66.0 2.61 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.486 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 20.6 m -86.18 -37.51 18.63 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 122.352 -0.499 . . . . 0.0 111.273 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -60.95 -47.17 87.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.471 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.1 tt0 -62.32 -42.17 99.15 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.626 0.25 . . . . 0.0 110.817 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.2 tp -61.32 -46.24 91.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.5 mt -70.06 -39.13 75.86 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.432 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -79.57 -4.88 53.52 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.2 m -58.37 -39.77 80.47 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -86.37 -90.01 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.959 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.96 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.3 0.571 . . . . 0.0 109.724 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -111.88 -57.11 2.31 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.419 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 19.0 ttpp -132.24 -43.45 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.184 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.24 34.72 4.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.816 0.847 . . . . 0.0 111.647 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.89 15.11 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.6 p -122.57 158.72 29.29 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.336 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.39 -40.82 82.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.144 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.86 98.26 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.719 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.67 -45.86 88.19 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.78 -24.5 52.89 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 96' ' ' GLN . 60.5 tp -60.03 -40.8 90.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.409 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.41 -43.21 99.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.937 0.399 . . . . 0.0 110.791 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.3 -40.05 77.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 121.618 0.723 . . . . 0.0 109.65 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.417 HD13 ' CB ' ' A' ' 103' ' ' ALA . 50.1 tp -60.85 -40.47 93.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.26 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 92' ' ' LEU . 96.5 mt-30 -61.66 -38.88 89.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.405 ' HG2' ' NH2' ' A' ' 52' ' ' ARG . 86.3 tt0 -62.66 -42.4 99.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 52.2 tpp -70.61 -40.0 73.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.379 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 81.75 40.09 11.2 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.578 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.62 ' ND1' ' HB1' ' A' ' 103' ' ' ALA . 20.7 t-160 -75.84 111.79 11.56 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.373 0.606 . . . . 0.0 110.73 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.32 -43.04 92.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.537 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.4 tpp180 -69.74 -38.72 76.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.62 ' HB1' ' ND1' ' A' ' 100' ' ' HIS . . . -60.11 -42.04 93.86 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.494 ' O ' HG22 ' A' ' 107' ' ' ILE . 46.8 pt -70.66 -27.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.868 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.82 -49.91 70.99 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.214 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.415 HD12 ' ND2' ' A' ' 109' ' ' ASN . 12.3 tp -83.92 -22.92 31.39 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.494 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.2 tt -61.84 -21.75 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.107 0.48 . . . . 0.0 111.148 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 54.3 m -62.17 -25.32 67.7 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.399 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.415 ' ND2' HD12 ' A' ' 106' ' ' LEU . 97.7 m-20 -70.33 -14.15 62.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.428 ' CE1' HD11 ' A' ' 25' ' ' LEU . 72.0 t80 -69.97 127.76 34.0 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.755 0.312 . . . . 0.0 110.587 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -151.74 41.38 0.74 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.659 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.26 131.42 51.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 0.0 110.982 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 19.1 m -108.47 3.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.56 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.6 tp -108.75 121.6 45.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.8 m -131.5 149.41 73.47 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.106 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.25 145.15 53.5 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.331 2.021 . . . . 0.0 112.603 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 79.9 p -96.74 -6.56 36.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.329 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -138.06 135.51 35.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.272 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -72.87 136.46 45.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.8 m -134.66 153.28 52.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.371 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -109.5 128.8 55.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.698 0.285 . . . . 0.0 110.277 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 70.1 tp60 -130.04 127.77 40.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.114 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 57.06 39.31 29.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.516 0.51 . . . . 0.0 111.593 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.215 179.978 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 120.84 0.353 . . . . 0.0 110.812 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.47 -38.99 92.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.355 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -125.71 148.39 49.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.49 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -152.1 163.96 30.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.127 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 91.9 p -73.46 160.34 31.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.909 0.385 . . . . 0.0 111.378 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.1 mtp -126.12 147.29 49.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -148.01 156.55 42.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.902 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.53 174.76 42.63 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.0 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -108.19 137.95 45.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.778 0.323 . . . . 0.0 110.681 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 52.8 t -124.22 126.96 46.98 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.494 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -145.82 156.27 26.89 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.139 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -152.23 158.33 42.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 0.148 . . . . 0.0 110.868 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 64.53 -157.65 0.3 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.664 0.603 . . . . 0.0 111.603 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.0 -179.37 42.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.387 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.3 -89.33 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.18 0.592 . . . . 0.0 111.698 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.7 tp -108.16 125.45 51.64 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -75.19 109.92 9.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.106 0.479 . . . . 0.0 111.275 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 -7.75 52.59 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.928 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -103.9 21.47 16.27 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.295 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -70.67 119.72 15.24 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.36 161.67 12.1 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.071 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.03 -50.5 66.0 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -81.24 -35.65 30.95 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.43 0.633 . . . . 0.0 111.341 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.52 70.77 0.72 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.627 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.422 ' CG ' ' HZ2' ' A' ' 84' ' ' LYS . 91.3 mt -46.11 156.28 0.48 Allowed Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 123.904 0.753 . . . . 0.0 111.372 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -38.43 165.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 124.91 3.74 . . . . 0.0 114.725 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -49.33 -9.35 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.041 3.16 . . . . 0.0 114.996 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.421 ' CB ' ' HA ' ' A' ' 107' ' ' ILE . . . -54.48 -35.9 63.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.374 0.13 . . . . 0.0 110.734 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.404 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.74 -78.8 0.59 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.42 -48.02 83.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.76 -51.52 58.14 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.654 -0.784 . . . . 0.0 114.467 -177.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.437 ' OE2' HG22 ' A' ' 36' ' ' VAL . 37.4 tp10 -70.57 -43.39 69.56 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.63 -39.34 88.24 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -71.78 -30.34 65.45 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 120.55 -0.46 . . . . 0.0 111.712 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.23 -56.75 3.38 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.437 HG22 ' OE2' ' A' ' 32' ' ' GLU . 54.3 t -64.26 -44.51 97.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.07 -19.15 61.86 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.351 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.494 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.0 t70 -59.75 -38.91 83.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 110.747 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.9 m -88.71 6.3 39.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.989 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.436 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 46.0 t -65.69 141.48 58.35 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.256 0.55 . . . . 0.0 111.536 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -132.68 50.68 2.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.252 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.98 -11.64 71.65 Favored Glycine 0 CA--C 1.52 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 113.49 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.8 98.52 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 117.253 0.527 . . . . 0.0 111.066 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -119.94 -23.31 6.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.909 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.436 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 78.47 111.69 0.2 Allowed Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.285 -179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.472 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 21.3 p90 -54.08 -44.4 71.14 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.235 0.518 . . . . 0.0 110.88 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.467 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 0.0 OUTLIER -84.71 -0.08 52.32 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.781 178.249 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.96 -45.38 95.23 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.446 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.0 mt -71.55 -42.92 67.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.847 0.323 . . . . 0.0 111.163 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.579 ' HB1' ' O ' ' A' ' 73' ' ' GLY . . . -65.34 -43.26 91.48 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.41 -40.08 95.35 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.694 -178.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -44.8 96.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -70.3 -45.43 66.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.172 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.0 m -148.53 138.93 22.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.665 0.269 . . . . 0.0 111.149 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.7 m -122.95 121.06 35.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.712 0.291 . . . . 0.0 111.674 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -159.82 158.37 30.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.994 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 30.1 m-90 -69.46 -38.99 78.01 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.788 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.3 mt -65.46 -40.28 93.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.912 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.436 ' O ' HG13 ' A' ' 63' ' ' ILE . 36.9 t70 -63.91 -46.07 86.45 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.7 m -70.87 -23.54 23.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.19 -46.48 88.75 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.982 0.42 . . . . 0.0 110.576 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.428 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 12.7 t60 -73.89 -25.97 60.29 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.287 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.498 ' O ' ' HB3' ' A' ' 72' ' ' SER . 81.2 mt -59.4 -42.25 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.068 0.461 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.539 ' O ' HG13 ' A' ' 67' ' ' VAL . 16.5 mm-40 -69.51 -27.44 65.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.029 179.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -70.26 -50.07 43.38 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.322 1.231 . . . . 0.0 114.322 -178.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.2 mt-10 -89.53 -3.56 58.28 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.539 HG13 ' O ' ' A' ' 64' ' ' GLU . 9.7 p -55.54 -34.62 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 118.158 0.435 . . . . 0.0 111.308 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.17 -4.12 58.36 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.942 0.401 . . . . 0.0 110.76 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -105.68 21.88 16.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.796 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.14 22.26 8.88 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.266 -0.969 . . . . 0.0 114.363 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 94.18 140.16 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.251 1.02 . . . . 0.0 112.212 177.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.9 t -131.87 -25.82 2.03 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.483 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.579 ' O ' ' HB1' ' A' ' 50' ' ' ALA . . . -57.01 -66.19 3.03 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.023 -1.084 . . . . 0.0 112.11 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.405 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 21.4 m -87.58 -36.63 17.43 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -60.37 -47.95 83.86 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.744 -177.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.562 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.3 tt0 -63.04 -40.61 98.24 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.868 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.15 -46.16 91.68 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.3 mt -68.74 -39.37 80.36 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.241 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -78.07 -5.64 52.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.3 m -58.92 -39.74 82.46 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -85.99 -89.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.42 -86.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -114.68 -54.01 2.61 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.436 ' HG2' ' H ' ' A' ' 86' ' ' LYS . 20.3 ttpp -132.62 -44.9 0.89 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.8 t30 47.87 32.17 2.63 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.221 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.436 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.38 132.57 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -81.95 160.45 23.35 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.65 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.31 -38.94 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.122 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.99 -39.04 97.59 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.726 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.32 -46.26 89.52 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.55 -24.38 45.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.405 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 61.4 tp -59.45 -40.53 87.16 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.627 0.251 . . . . 0.0 111.077 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -62.29 -41.3 98.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.559 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.63 -40.19 79.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.032 178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.31 -36.95 76.55 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.241 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 92' ' ' LEU . 99.0 mm-40 -62.97 -39.9 96.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.287 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -62.57 -46.08 89.98 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.789 0.328 . . . . 0.0 110.718 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.1 mmt -70.36 -36.59 74.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.15 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.463 ' O ' ' HD3' ' A' ' 101' ' ' ARG . . . 93.53 40.61 4.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.245 -0.979 . . . . 0.0 111.983 -179.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.511 ' CG ' ' HB2' ' A' ' 103' ' ' ALA . 2.1 t-80 -76.89 86.95 3.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.317 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.463 ' HD3' ' O ' ' A' ' 99' ' ' GLY . 1.4 mpp_? -63.18 -43.35 98.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.529 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -63.32 -39.9 95.85 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.688 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.511 ' HB2' ' CG ' ' A' ' 100' ' ' HIS . . . -60.87 -37.79 83.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.552 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.3 mt -60.21 -43.18 92.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.615 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -63.93 -43.21 96.59 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.44 -23.05 30.13 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.552 HG22 ' O ' ' A' ' 104' ' ' ILE . 9.7 tt -64.74 -20.96 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.845 0.355 . . . . 0.0 111.632 -179.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 79.7 p -69.08 -16.7 63.74 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.448 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -71.73 -14.65 62.08 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.576 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -60.25 -48.39 81.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.287 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 76.6 71.31 1.19 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.468 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.38 58.77 1.73 Allowed 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 74.9 t -65.74 -43.38 93.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.159 0.504 . . . . 0.0 110.444 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -148.0 165.53 30.46 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.1 m -80.22 123.73 83.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.875 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -55.73 -35.22 92.92 Favored 'Trans proline' 0 N--CA 1.48 0.688 0 C-N-CA 123.245 2.63 . . . . 0.0 113.099 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.2 p -63.82 -24.48 67.77 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.691 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 56.24 40.79 29.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 122.996 0.518 . . . . 0.0 112.217 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -85.28 67.93 10.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.995 0.426 . . . . 0.0 110.971 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 90.9 p -71.25 -21.18 62.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.524 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -116.75 128.11 55.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.633 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -104.94 140.57 37.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.703 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.08 -39.43 94.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.335 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.233 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.997 0.427 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -122.87 142.97 50.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.613 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -127.91 145.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.45 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.22 -179.32 42.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.148 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.7 p -96.07 134.2 39.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.732 0.301 . . . . 0.0 110.705 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 61.5 mtt -131.48 -52.62 1.01 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.102 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.79 56.58 6.54 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.64 0.588 . . . . 0.0 112.069 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -61.79 -40.65 99.09 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.053 -0.594 . . . . 0.0 113.273 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 53.87 41.13 32.15 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.0 m -124.93 152.04 44.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.927 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.27 161.72 8.93 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.532 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.84 152.09 32.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 122.038 0.135 . . . . 0.0 110.682 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 -127.88 -65.89 0.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.994 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.47 156.04 30.23 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.692 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.93 -39.84 95.08 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.94 0.4 . . . . 0.0 111.604 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -108.48 149.31 28.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.197 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -72.41 108.71 5.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.134 0.492 . . . . 0.0 111.154 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.23 -7.67 50.61 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.968 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -103.86 21.62 15.98 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.586 -179.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.8 m -75.61 117.44 17.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.652 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.9 169.21 21.63 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.735 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -64.18 -50.52 67.79 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.406 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . 99.7 m-85 -91.92 -35.68 13.88 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.277 0.56 . . . . 0.0 111.133 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.9 70.76 1.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.307 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.0 mt -47.43 156.32 0.64 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.642 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.55 166.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.257 3.972 . . . . 0.0 114.977 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.89 -8.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.232 0 C-N-CA 124.112 3.208 . . . . 0.0 115.312 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.7 -36.55 67.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 118.025 0.375 . . . . 0.0 110.219 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.451 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.66 -78.37 0.59 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.9 tp -61.11 -48.72 80.35 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.44 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -61.07 -51.26 59.54 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 120.473 -0.87 . . . . 0.0 114.343 -177.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.457 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.39 -43.28 70.37 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.22 -37.89 84.35 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.61 -0.436 . . . . 0.0 112.085 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.609 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.7 p -75.28 -31.7 60.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.774 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.97 -56.89 3.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.49 -44.77 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.55 HD23 ' NE2' ' A' ' 100' ' ' HIS . 70.5 mt -72.84 -19.42 61.31 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.187 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.609 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 39.6 t0 -62.02 -36.19 80.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.168 0.508 . . . . 0.0 110.158 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.8 m -88.1 7.41 31.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.996 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.518 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.7 t -62.76 142.77 58.02 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.411 0.624 . . . . 0.0 111.717 -179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -130.35 40.0 3.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.849 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.15 -11.96 69.81 Favored Glycine 0 CA--C 1.519 0.3 0 CA-C-N 115.456 -0.793 . . . . 0.0 113.094 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.77 -42.88 97.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.967 0.383 . . . . 0.0 111.654 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 92.0 mt -113.8 -22.06 10.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.078 0.466 . . . . 0.0 110.5 179.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.518 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 77.9 109.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.705 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.4 p90 -52.12 -52.38 51.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 117.107 0.454 . . . . 0.0 110.641 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -83.55 0.64 45.7 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.752 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.74 -47.08 91.03 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.158 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.7 mt -73.38 -43.19 61.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.96 0.38 . . . . 0.0 111.376 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.72 -40.73 95.82 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -60.68 -43.74 97.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.243 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -64.79 -41.11 96.08 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.881 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.08 -44.2 76.82 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.943 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.1 m -141.86 127.11 18.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.737 0.303 . . . . 0.0 110.871 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 m -115.01 99.58 7.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.666 0.27 . . . . 0.0 110.585 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.4 m -131.67 146.62 52.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.931 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.483 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 48.8 t-105 -81.15 150.89 28.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.539 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 57' ' ' TRP . 83.9 mt 77.32 -30.65 0.17 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.862 0.865 . . . . 0.0 112.167 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -62.88 -35.48 80.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.678 0.275 . . . . 0.0 111.376 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 19.0 m -59.84 -20.65 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.31 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -63.54 -42.4 98.41 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.837 0.351 . . . . 0.0 110.411 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -68.17 -29.27 68.1 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.397 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.554 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.9 mt -60.01 -42.8 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.433 0.635 . . . . 0.0 109.63 178.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.623 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.19 -35.93 76.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.172 178.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -62.78 -47.59 82.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.1 mt-10 -89.56 -3.62 58.23 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.1 p -57.13 -32.48 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 118.18 0.445 . . . . 0.0 111.146 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.83 -4.67 58.43 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.922 0.391 . . . . 0.0 110.693 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -106.38 21.56 17.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.728 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.591 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 22.3 8.9 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.391 -0.909 . . . . 0.0 114.254 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.591 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 93.75 142.65 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.279 1.032 . . . . 0.0 112.129 177.512 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.6 t -130.74 -31.74 1.73 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.964 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.438 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -54.44 -62.99 5.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.299 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.485 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.14 -37.3 16.29 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.384 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.431 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.8 ttt180 -62.3 -47.41 84.41 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.7 tt0 -63.25 -40.02 96.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.734 0.302 . . . . 0.0 110.632 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.3 tp -61.16 -46.38 90.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.171 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.17 -40.21 71.42 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.998 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -82.52 -5.94 59.03 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -59.13 -41.94 89.45 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -85.8 -89.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.48 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.19 -86.91 0.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.293 0.568 . . . . 0.0 110.596 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.406 ' OE1' ' HB2' ' A' ' 23' ' ' PHE . 91.8 mt-30 -112.46 -57.23 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.451 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 16.8 ttpp -131.73 -42.45 1.02 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.2 t30 49.28 30.44 3.16 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.135 0.974 . . . . 0.0 111.857 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.406 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 9.6 mptt -139.57 164.24 30.42 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.0 p -124.95 160.16 29.55 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.539 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.51 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.8 mp -59.45 -41.85 85.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.971 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.81 99.4 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.914 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.74 -40.28 95.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.87 -29.42 61.01 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.4 mt -59.6 -37.51 78.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -58.97 -46.49 87.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.286 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 92.6 t -70.51 -39.57 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.727 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 mp -57.78 -39.47 77.55 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.35 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -63.8 -38.85 92.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.142 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -63.17 -40.6 98.0 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.913 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 95.7 mmm -90.4 -10.75 42.73 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.9 39.73 46.02 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.853 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.55 ' NE2' HD23 ' A' ' 37' ' ' LEU . 16.1 m80 -74.28 81.39 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.085 0.469 . . . . 0.0 111.579 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -63.21 -42.2 99.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.57 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.2 tpp85 -62.21 -41.55 98.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.025 0.44 . . . . 0.0 110.761 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.27 -39.17 89.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.305 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.582 ' O ' HG23 ' A' ' 107' ' ' ILE . 95.5 mt -62.66 -42.89 97.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.631 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.16 -41.45 99.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.706 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.457 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.36 -23.51 37.67 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.582 HG23 ' O ' ' A' ' 104' ' ' ILE . 0.9 OUTLIER -64.82 -20.3 27.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.859 0.362 . . . . 0.0 111.251 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.0 p -71.03 -7.25 45.06 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.604 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -68.62 -27.1 65.73 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.758 0.313 . . . . 0.0 110.978 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -103.3 106.95 17.59 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -61.78 -40.17 98.45 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.012 -0.54 . . . . 0.0 114.135 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -127.18 147.92 50.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.949 0.374 . . . . 0.0 110.91 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.2 t -96.72 121.23 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.92 0.391 . . . . 0.0 110.401 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -107.48 125.97 51.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.2 m -109.69 105.18 56.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.872 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.5 158.73 43.85 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.831 2.354 . . . . 0.0 112.557 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 m -64.06 137.89 58.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.509 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -123.08 134.88 54.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.788 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.74 -39.59 93.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.223 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 t 61.22 -155.22 0.36 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.228 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 54.62 -124.63 2.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 123.593 0.558 . . . . 0.0 111.233 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 56.48 -113.14 0.74 Allowed 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.422 0.452 . . . . 0.0 111.408 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -125.33 143.27 51.05 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.522 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.475 -1.18 . . . . 0.0 112.262 179.999 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 121.035 0.445 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -120.03 135.76 54.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.473 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -103.73 5.71 36.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.482 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.03 -155.21 49.03 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.446 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 51.0 m 56.46 45.55 22.36 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.966 0.412 . . . . 0.0 111.56 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.466 ' SD ' ' HG2' ' A' ' 64' ' ' GLU . 75.4 mtm -125.31 147.47 49.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.162 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.6 160.9 42.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.041 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -158.75 -179.91 33.94 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.413 -0.899 . . . . 0.0 112.858 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -148.46 -179.97 7.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.403 0.281 . . . . 0.0 110.473 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.6 m -114.76 148.89 37.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.817 0.341 . . . . 0.0 111.157 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.63 143.56 15.97 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.344 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.24 95.86 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 68.61 -84.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.725 0.64 . . . . 0.0 111.234 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 99.99 155.53 28.03 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.934 -0.65 . . . . 0.0 113.039 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.06 -40.78 97.03 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.824 0.345 . . . . 0.0 111.712 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.3 mt -81.62 144.29 31.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.355 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.6 p -81.63 110.15 16.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.862 0.363 . . . . 0.0 111.463 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.96 -11.13 39.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.28 0.562 . . . . 0.0 110.587 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -108.76 21.03 17.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.559 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.7 t -72.43 125.46 27.44 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.229 0.538 . . . . 0.0 112.422 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -167.56 -178.21 3.85 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.586 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -80.38 -58.98 2.88 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -72.9 -35.4 67.09 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.608 0.718 . . . . 0.0 110.691 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -110.56 71.33 0.75 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.092 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.43 ' CG ' ' HZ3' ' A' ' 84' ' ' LYS . 95.3 mt -48.24 156.54 0.77 Allowed Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -36.12 163.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.632 3.555 . . . . 0.0 115.176 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.418 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 74.3 Cg_exo -50.52 -8.9 0.16 Allowed 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 123.978 3.119 . . . . 0.0 114.634 -179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.17 -35.59 64.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -108.3 -79.5 0.58 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 62.4 tp -62.3 -47.68 83.21 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -60.45 -52.26 53.71 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.593 -0.813 . . . . 0.0 114.645 -177.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.48 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -71.12 -43.23 68.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.35 -39.73 89.37 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.0 p -73.13 -30.14 63.4 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.847 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -55.82 3.81 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.63 -45.25 95.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.521 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 82.6 mt -74.39 -17.82 60.75 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.713 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.653 ' N ' ' HZ3' ' A' ' 71' ' ' LYS . 19.3 t70 -59.56 -38.74 81.9 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.104 0.478 . . . . 0.0 110.541 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.6 p -90.29 10.04 26.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.354 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -66.5 147.24 53.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.18 0.514 . . . . 0.0 111.237 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -136.53 49.54 2.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.242 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.94 -10.3 74.77 Favored Glycine 0 CA--C 1.519 0.34 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.422 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.64 99.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 111.154 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -122.38 -32.39 3.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.17 114.92 1.4 Allowed Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.583 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.461 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 9.0 p90 -55.15 -44.17 74.86 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.036 0.418 . . . . 0.0 110.572 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.461 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 1.5 ppt_? -84.83 -0.5 54.14 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.728 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -48.69 83.41 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.299 -177.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.0 mt -73.28 -41.82 63.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.9 0.381 . . . . 0.0 111.214 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.479 ' HB1' ' O ' ' A' ' 73' ' ' GLY . . . -63.74 -43.1 97.47 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -60.73 -44.38 96.72 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.368 0.417 . . . . 0.0 111.636 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -67.91 -40.59 83.39 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.6 tp -70.09 -45.47 66.91 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.6 m -144.52 150.83 38.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.245 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 89.6 p -142.72 152.71 42.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.699 0.285 . . . . 0.0 110.961 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.8 t -162.72 178.75 8.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.611 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.6 m0 -82.81 129.45 34.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.495 0.188 . . . . 0.0 110.805 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.9 mt 57.7 30.06 18.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.099 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.11 -20.44 61.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 32.4 m -75.82 -17.16 15.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -60.85 -47.65 85.4 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.246 -178.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.506 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 11.3 p-80 -78.69 -19.11 53.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.823 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.569 ' O ' ' HB3' ' A' ' 72' ' ' SER . 77.8 mt -61.96 -41.18 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 121.303 0.573 . . . . 0.0 110.457 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.605 ' O ' HG12 ' A' ' 67' ' ' VAL . 96.3 mt-10 -69.55 -34.0 73.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.995 178.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.2 mttt -62.4 -47.98 81.74 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.595 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.4 mm-40 -89.5 -4.31 57.98 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.7 p -57.11 -30.82 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 118.233 0.47 . . . . 0.0 110.894 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -88.33 -5.22 58.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.12 0.486 . . . . 0.0 110.596 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -109.36 22.91 15.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.766 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.674 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.61 11.55 30.59 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-O 118.858 -0.968 . . . . 0.0 114.633 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.674 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 105.73 147.76 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.112 1.365 . . . . 0.0 111.744 177.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.597 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.6 t -132.34 -26.06 1.9 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.762 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.479 ' O ' ' HB1' ' A' ' 50' ' ' ALA . . . -58.92 -66.56 2.71 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 119.036 -1.554 . . . . 0.0 111.007 178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -87.03 -40.02 15.1 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.406 ' HB3' ' O ' ' A' ' 71' ' ' LYS . 76.0 ttt-85 -61.55 -47.91 83.41 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.597 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.9 tp10 -61.75 -43.05 99.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.515 0.198 . . . . 0.0 110.859 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.1 tp -63.59 -45.74 89.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.588 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.1 mt -67.16 -39.11 86.45 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.888 0.375 . . . . 0.0 111.178 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -78.2 -6.27 54.34 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.2 m -59.18 -39.74 83.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -85.9 -90.14 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.198 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.98 -86.49 0.5 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.168 0.509 . . . . 0.0 109.679 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -111.16 -57.61 2.22 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.459 ' HG2' ' H ' ' A' ' 86' ' ' LYS . 17.2 ttpp -133.13 -42.76 0.88 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.71 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.0 t30 49.4 32.84 4.89 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.153 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.459 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.59 130.4 26.07 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.72 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 51.5 p -81.55 160.2 23.94 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.991 -0.683 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.5 -38.4 77.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.041 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.4 -39.32 97.62 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.915 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.98 -45.19 93.58 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.583 ' O ' HD11 ' A' ' 95' ' ' LEU . 0.2 OUTLIER -78.01 -23.94 48.1 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.397 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.2 tp -58.98 -40.92 86.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.087 -179.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -61.92 -41.48 97.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 110.265 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 76.5 t -67.98 -41.55 84.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.154 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.583 HD11 ' O ' ' A' ' 91' ' ' LEU . 6.5 mp -60.15 -39.21 85.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.119 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -62.94 -40.63 98.23 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -65.19 -42.89 93.17 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.566 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.43 -38.56 81.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.196 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.69 26.15 39.51 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.612 -0.804 . . . . 0.0 113.464 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.538 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 20.7 t-160 -77.48 106.16 9.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.098 0.449 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.96 -42.23 97.33 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.2 tpp180 -62.57 -42.25 99.43 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.865 0.364 . . . . 0.0 110.96 -179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.538 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -61.63 -42.04 98.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.497 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.643 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.2 mt -64.24 -43.28 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.38 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -61.0 -47.96 84.03 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.443 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.48 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -76.99 -24.94 52.22 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.9 tt -64.7 -20.68 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 120.816 0.341 . . . . 0.0 111.723 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 72.2 p -75.62 -8.09 55.92 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.595 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -87.49 16.09 5.88 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.029 0.442 . . . . 0.0 111.238 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 58.9 t80 -83.33 127.9 34.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.672 179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -104.32 154.42 17.58 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.067 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.09 141.77 58.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.874 0.369 . . . . 0.0 111.349 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 26.9 m -128.52 159.73 39.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.886 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 mp -95.3 137.16 34.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.744 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.7 m -80.03 125.64 81.34 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.61 151.38 64.2 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.724 2.282 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.2 m -93.43 -0.05 56.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.299 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -99.48 140.29 33.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.79 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -147.51 156.19 42.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.802 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.9 m -95.2 -2.05 50.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.394 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -92.44 93.45 8.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.041 0.448 . . . . 0.0 110.254 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -100.78 0.99 39.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.5 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -63.09 -41.54 99.43 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.357 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.499 -1.167 . . . . 0.0 112.663 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 121.014 0.435 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -105.28 126.69 52.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -119.8 142.23 48.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.517 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.9 173.39 42.45 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.601 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.0 m -130.75 150.5 51.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.695 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtm -105.81 137.8 43.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.506 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.58 97.51 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.922 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.07 179.98 50.97 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.553 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -106.19 117.98 35.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.627 0.251 . . . . 0.0 110.749 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 97.3 m -64.93 -40.31 94.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.531 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 119.92 -175.25 15.83 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.235 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -106.68 120.98 43.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.728 0.264 . . . . 0.0 110.919 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -137.64 167.26 22.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.015 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' HA2' ' OD1' ' A' ' 109' ' ' ASN . . . 103.81 -17.18 49.95 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.83 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -104.14 -70.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.924 0.393 . . . . 0.0 110.514 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.1 mt -109.84 139.08 45.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.261 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 p -103.53 110.04 21.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.059 0.457 . . . . 0.0 110.839 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.92 -7.25 54.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.162 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -105.25 21.27 17.43 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.209 -179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -70.79 120.03 15.8 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.12 164.45 20.29 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.484 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.43 -50.37 70.03 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.62 -35.36 14.27 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.143 0.496 . . . . 0.0 111.589 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -103.61 70.8 1.04 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.46 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' CG ' ' HZ1' ' A' ' 84' ' ' LYS . 92.0 mt -43.51 157.51 0.26 Allowed Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 124.283 0.989 . . . . 0.0 112.454 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -42.32 167.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 124.621 3.547 . . . . 0.0 113.845 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.402 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 87.3 Cg_exo -48.73 -9.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.821 3.014 . . . . 0.0 115.083 -178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.5 -35.36 67.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.868 0.303 . . . . 0.0 110.937 179.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.543 HD13 ' CB ' ' A' ' 91' ' ' LEU . 8.0 tp -107.24 -77.55 0.6 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -49.75 71.11 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.402 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -59.34 -52.29 54.08 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.559 -0.829 . . . . 0.0 115.049 -177.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.8 tm-20 -71.28 -43.82 66.42 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.449 ' CD1' HD12 ' A' ' 29' ' ' LEU . 91.6 mt -66.68 -39.58 88.2 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.625 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 19.2 p -74.32 -32.97 63.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.191 -0.604 . . . . 0.0 112.17 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.7 -54.52 4.48 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 56.9 t -64.19 -44.83 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.501 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 mt -75.64 -17.23 60.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.37 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.625 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 36.5 t0 -60.66 -37.13 80.56 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.054 0.454 . . . . 0.0 110.967 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.9 m -85.72 9.6 15.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.128 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.473 ' SG ' HD11 ' A' ' 44' ' ' LEU . 48.3 t -66.18 144.66 56.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.254 0.549 . . . . 0.0 111.883 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -133.63 46.26 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.87 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.4 -11.99 70.51 Favored Glycine 0 CA--C 1.519 0.33 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.391 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.82 -42.46 97.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.956 0.407 . . . . 0.0 111.551 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.473 HD11 ' SG ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -117.05 -26.15 6.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.308 179.095 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.466 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.63 108.07 0.25 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.165 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.49 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 16.0 p90 -54.89 -40.3 69.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 117.211 0.505 . . . . 0.0 111.125 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.04 1.06 41.99 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.996 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.71 -43.52 96.31 Favored Glycine 0 C--N 1.329 0.177 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.713 -178.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.41 -42.4 68.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.768 0.318 . . . . 0.0 111.003 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.64 ' HB1' ' O ' ' A' ' 73' ' ' GLY . . . -65.54 -40.59 93.06 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.03 -41.11 97.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.996 -178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -41.11 96.9 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.854 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.09 -42.69 69.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.159 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 t 56.89 61.55 2.57 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.848 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.9 p -65.28 -39.91 93.2 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.847 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 87.5 p -161.25 159.96 29.31 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.82 0.343 . . . . 0.0 111.06 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -65.7 -42.75 90.82 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.831 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.78 1.48 38.75 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.6 -39.06 86.73 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.259 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.478 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 29.0 m -62.45 -26.9 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -63.24 -45.8 89.86 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.992 0.425 . . . . 0.0 110.672 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -74.38 -22.43 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.419 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.48 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.86 -43.73 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.11 0.481 . . . . 0.0 110.5 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.593 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.9 mt-10 -66.94 -36.58 82.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.957 0.408 . . . . 0.0 110.935 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.34 -47.2 83.15 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -177.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.527 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 6.1 mt-10 -90.05 -4.08 57.59 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.593 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.1 p -56.54 -32.62 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.209 0.459 . . . . 0.0 111.235 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.82 -4.73 58.41 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.853 178.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -106.08 21.31 17.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.907 -178.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.626 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.62 21.15 10.01 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.259 -0.972 . . . . 0.0 114.233 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.626 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 98.9 148.01 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.568 1.147 . . . . 0.0 112.04 177.479 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.527 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.1 t -137.13 -37.26 0.65 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.659 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.64 ' O ' ' HB1' ' A' ' 50' ' ' ALA . . . -50.68 -62.8 4.94 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.931 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 9.2 t -88.21 -36.06 16.99 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.266 0.533 . . . . 0.0 111.712 179.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.18 -47.27 85.24 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.2 tt0 -62.58 -40.14 95.93 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.645 0.26 . . . . 0.0 110.641 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.7 tp -61.51 -46.96 87.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 91.1 mt -72.26 -39.88 68.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.566 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -78.09 -6.77 55.71 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.9 p -57.86 -38.63 76.05 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' A' ' 123' ' ' GLU . 67.0 m95 -87.38 -91.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.016 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.94 -86.8 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -108.7 -57.87 2.08 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.54 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 23.2 ttpp -133.07 -43.84 0.87 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.94 176.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.2 t30 47.97 34.7 4.3 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.556 0.742 . . . . 0.0 111.911 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -139.45 168.14 20.49 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 64.8 p -124.84 158.59 33.07 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.528 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.498 HD11 HD11 ' A' ' 29' ' ' LEU . 1.2 mm -60.56 -37.66 75.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.924 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.91 -41.35 99.27 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.716 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.47 -42.34 83.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.057 0.456 . . . . 0.0 111.036 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.543 ' CB ' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -75.59 -24.14 56.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.802 -179.476 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.52 -42.14 91.57 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.945 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -62.09 -41.59 98.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.433 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -69.09 -41.24 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.062 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 2.0 mp -59.91 -42.96 95.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.253 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -63.9 -40.8 97.33 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.204 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -63.95 -46.71 83.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.4 mmm -70.29 -38.57 75.04 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.73 40.0 5.41 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.446 -0.883 . . . . 0.0 113.266 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -78.44 97.18 5.58 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.994 0.397 . . . . 0.0 110.588 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.509 ' O ' HG12 ' A' ' 104' ' ' ILE . 83.6 mtp180 -63.67 -41.83 98.13 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.691 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? -65.41 -37.56 87.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.044 0.449 . . . . 0.0 111.666 -179.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.31 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.681 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.593 ' O ' HG22 ' A' ' 107' ' ' ILE . 36.9 pt -69.03 -25.76 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.429 -179.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.532 ' O ' HG21 ' A' ' 108' ' ' THR . 77.1 m-70 -70.56 -39.97 73.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.863 0.364 . . . . 0.0 110.717 178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.403 HD12 ' OD1' ' A' ' 109' ' ' ASN . 0.2 OUTLIER -84.93 -22.8 29.11 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.593 HG22 ' O ' ' A' ' 104' ' ' ILE . 13.6 tt -61.97 -21.18 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.642 0.258 . . . . 0.0 111.328 -179.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 105' ' ' HIS . 7.4 t -65.77 -16.71 64.04 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.598 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.436 ' OD1' ' HA2' ' A' ' 14' ' ' GLY . 27.4 m120 -78.1 -10.44 59.62 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 0.0 111.421 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -71.88 137.92 47.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.528 179.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 128.34 -7.06 6.7 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.582 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.034 0.445 . . . . 0.0 110.837 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 30.2 m -129.11 160.72 39.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.564 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.7 tp -87.63 126.16 34.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.585 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 74.6 m -70.1 147.05 95.48 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.67 146.8 55.53 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.375 2.05 . . . . 0.0 112.371 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.1 p -87.61 -11.18 49.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.193 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -129.06 149.19 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.824 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -77.42 153.73 33.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.546 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 89.5 p -66.14 -30.54 71.04 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.612 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 59.67 30.4 20.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.408 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -128.63 148.54 50.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.098 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.411 ' HA ' ' O ' ' A' ' 81' ' ' TRP . 98.7 mt-10 -118.74 133.48 55.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 110.754 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.344 -1.254 . . . . 0.0 112.495 179.827 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.136 0.493 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -149.35 158.27 44.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.719 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -127.87 148.19 50.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.731 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 121.57 105.87 1.95 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.234 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.8 p -157.62 167.08 31.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.609 0.242 . . . . 0.0 110.866 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.2 mtt -125.93 151.29 47.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.447 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.06 48.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.978 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.68 167.46 44.45 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.909 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -97.83 109.01 21.85 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.686 0.279 . . . . 0.0 110.661 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -121.9 129.36 52.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.438 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -70.37 145.86 41.47 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.913 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.81 30.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.856 0.36 . . . . 0.0 111.302 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -77.3 148.36 35.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.948 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -86.88 -174.25 49.09 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.95 -0.643 . . . . 0.0 113.051 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.93 94.19 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 111.665 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.35 121.19 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.138 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -83.07 108.28 16.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.183 0.516 . . . . 0.0 111.471 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.61 -7.45 50.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.902 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -103.42 21.76 15.42 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.442 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.4 m -78.64 113.91 17.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.492 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 20.6 mt -155.96 165.58 36.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.005 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.6 tp -62.77 -49.46 74.91 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -83.27 -35.39 25.35 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.156 0.503 . . . . 0.0 112.007 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -113.09 71.23 0.74 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.703 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.422 ' CG ' ' HZ2' ' A' ' 84' ' ' LYS . 86.1 mt -41.0 155.4 0.21 Allowed Pre-proline 0 CA--C 1.54 0.577 0 O-C-N 123.926 0.766 . . . . 0.0 112.008 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -38.01 164.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 125.041 3.827 . . . . 0.0 114.848 -179.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.21 -9.17 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 124.131 3.221 . . . . 0.0 115.18 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.94 -35.55 64.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 117.634 0.197 . . . . 0.0 110.521 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.91 -79.12 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.21 -47.44 84.42 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -177.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.51 -51.12 60.69 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.523 -0.846 . . . . 0.0 114.14 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.449 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.96 -43.26 68.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.59 -38.68 84.38 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.624 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -73.97 -30.85 62.72 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.644 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.5 -57.35 3.1 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.66 -45.58 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.61 -19.51 61.45 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.485 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.624 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 37.0 t0 -61.29 -37.29 82.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 110.28 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -85.69 1.65 48.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.014 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.473 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 52.4 t -63.45 139.34 58.76 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.224 0.535 . . . . 0.0 111.553 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.52 45.78 2.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.938 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.04 -10.96 73.01 Favored Glycine 0 CA--C 1.52 0.35 0 CA-C-N 115.535 -0.757 . . . . 0.0 113.127 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.11 98.76 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.994 0.397 . . . . 0.0 111.347 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.68 -23.6 9.15 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.473 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 80.78 110.37 0.3 Allowed Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.393 -178.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.9 p90 -50.95 -50.35 58.11 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 117.293 0.546 . . . . 0.0 110.627 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.0 ptt85 -84.04 1.33 44.41 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.694 177.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.91 -49.11 73.56 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.3 -177.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.25 -41.63 69.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.073 0.437 . . . . 0.0 111.372 179.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -64.68 -41.4 96.08 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -60.55 -42.63 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.934 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -64.23 -41.3 97.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.106 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.7 tp -70.41 -45.56 65.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.0 m -146.18 140.02 26.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.3 m -120.8 120.6 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.612 0.244 . . . . 0.0 110.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -158.1 141.34 15.11 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.61 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -62.47 -45.31 93.63 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.56 -38.74 90.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.64 -45.8 91.17 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.148 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.402 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 35.4 m -70.49 -25.33 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.816 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.61 -45.11 94.4 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.174 0.511 . . . . 0.0 109.937 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -70.74 -27.72 64.16 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.842 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.537 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.1 mt -59.97 -42.71 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.129 0.49 . . . . 0.0 110.572 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.609 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.4 mt-10 -65.92 -36.53 83.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.458 . . . . 0.0 110.847 178.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.53 -49.14 74.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -178.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.535 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 1.4 mm-40 -89.95 -3.45 58.03 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.609 HG11 ' O ' ' A' ' 64' ' ' GLU . 6.2 p -56.18 -33.42 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 118.177 0.444 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.05 -4.34 58.4 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.808 0.337 . . . . 0.0 110.762 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.97 21.57 17.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.883 -178.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.609 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.86 20.79 10.24 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.282 -0.961 . . . . 0.0 114.269 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.609 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.0 OUTLIER 95.82 141.52 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.388 1.075 . . . . 0.0 112.161 177.493 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.689 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.4 t -131.12 -28.8 1.9 Allowed 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.331 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -56.23 -63.14 5.58 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.745 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.468 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.84 -40.12 13.36 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 179.224 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.457 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 76.9 ttt180 -62.31 -49.89 73.83 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -177.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.689 ' HB3' ' O ' ' A' ' 72' ' ' SER . 52.4 tp10 -64.51 -39.19 93.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.295 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.0 tp -60.51 -46.52 89.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.937 0.399 . . . . 0.0 110.338 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.403 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 85.7 mt -71.5 -39.59 70.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.195 0.522 . . . . 0.0 111.197 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -74.55 -6.47 48.65 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.616 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 t -58.03 -42.1 84.63 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 61.5 m95 -85.73 -90.05 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.988 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.71 -86.26 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.216 0.532 . . . . 0.0 109.575 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.48 -56.95 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.422 ' HZ2' ' CG ' ' A' ' 25' ' ' LEU . 21.5 ttpp -132.02 -42.68 0.99 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.482 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 45.63 34.01 1.6 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.669 0.788 . . . . 0.0 112.563 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.5 169.01 18.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.3 p -119.38 158.32 26.41 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.469 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.23 -38.26 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.057 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.31 -39.6 97.95 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.824 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.83 -46.53 87.5 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.752 0.279 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.58 ' O ' HD11 ' A' ' 95' ' ' LEU . 1.2 mm? -76.32 -24.49 54.31 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.286 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.07 -38.1 78.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -60.93 -41.83 96.98 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.839 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.495 HG21 ' O ' ' A' ' 91' ' ' LEU . 28.9 m -83.09 -23.95 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.121 179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.58 HD11 ' O ' ' A' ' 91' ' ' LEU . 2.8 mp -62.78 -46.61 87.21 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 110.334 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.69 -39.44 91.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.626 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -63.29 -43.5 97.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.652 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -68.69 -38.75 80.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.88 22.86 19.51 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.095 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.448 ' CD2' ' HB2' ' A' ' 103' ' ' ALA . 1.2 t60 -78.08 99.02 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.087 0.47 . . . . 0.0 110.996 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.69 -40.8 96.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.809 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.19 -41.4 96.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.856 0.36 . . . . 0.0 110.739 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.448 ' HB2' ' CD2' ' A' ' 100' ' ' HIS . . . -61.31 -39.49 90.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.304 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.635 ' O ' HG23 ' A' ' 107' ' ' ILE . 44.2 mm -63.97 -43.66 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.749 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -64.64 -40.78 96.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.648 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.449 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -79.79 -22.78 42.72 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.635 HG23 ' O ' ' A' ' 104' ' ' ILE . 2.5 tp -64.55 -20.84 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.511 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.1 p -74.09 -10.18 59.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -89.03 16.28 7.32 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.195 0.522 . . . . 0.0 111.187 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 38.7 t80 -88.54 127.17 35.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.307 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.62 77.9 0.24 Allowed Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.887 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -149.73 168.13 24.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.847 0.356 . . . . 0.0 111.33 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.9 m -89.11 36.02 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.277 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.92 -168.3 0.15 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.292 0.637 . . . . 0.0 111.795 179.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 63.4 m -129.37 150.49 75.72 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.513 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.81 154.62 63.48 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.474 2.116 . . . . 0.0 112.382 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 64.1 m -105.67 141.81 36.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.834 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -125.82 145.75 50.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.637 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -126.93 149.6 49.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.585 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 98.7 p -150.24 160.74 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.611 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 54.5 p90 -149.1 161.53 41.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.486 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -150.12 159.5 44.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.668 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.68 -39.4 93.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.165 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.408 -1.218 . . . . 0.0 112.504 -179.949 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.92 0.391 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -124.76 145.61 49.63 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.561 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -150.31 160.78 43.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.645 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.68 146.53 32.74 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.498 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m -102.68 85.48 2.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.845 0.355 . . . . 0.0 111.03 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.6 mmt -123.13 140.53 52.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.116 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 40' ' ' CYS . . . -148.77 151.54 34.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -104.11 -168.22 25.0 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.032 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -136.86 103.43 5.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -150.71 137.28 18.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.713 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -95.62 -160.14 33.07 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.606 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.76 147.07 53.97 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.448 0.166 . . . . 0.0 110.934 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -61.03 -46.85 89.04 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 154.0 169.93 19.41 Favored Glycine 0 CA--C 1.517 0.206 0 C-N-CA 120.299 -0.953 . . . . 0.0 113.113 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.35 -39.54 92.47 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -102.54 159.89 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.753 -179.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.438 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 2.8 p -95.91 109.06 21.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.083 0.468 . . . . 0.0 111.692 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.93 -10.23 40.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.241 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -103.79 21.6 15.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.369 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.2 m -67.64 119.66 12.76 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.74 0.305 . . . . 0.0 111.72 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.17 163.3 22.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.428 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.0 tp -64.38 -50.58 67.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -85.25 -35.38 21.6 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.565 0.697 . . . . 0.0 111.325 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.5 70.44 0.73 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.348 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.401 HD11 ' CE1' ' A' ' 110' ' ' TYR . 94.7 mt -45.84 155.52 0.49 Allowed Pre-proline 0 N--CA 1.466 0.356 0 O-C-N 124.161 0.913 . . . . 0.0 111.387 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -35.4 160.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 124.683 3.589 . . . . 0.0 114.888 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.438 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 85.3 Cg_exo -49.39 -9.17 0.11 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.338 3.359 . . . . 0.0 114.889 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.05 62.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.71 0.232 . . . . 0.0 110.676 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.413 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 7.5 tp -107.85 -78.28 0.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -61.32 -48.73 80.01 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.64 -52.73 48.93 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.676 -0.773 . . . . 0.0 114.817 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -72.2 -42.01 66.27 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.4 -38.76 90.93 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.675 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.6 p -72.15 -29.46 64.06 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.357 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -59.42 2.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.03 -44.44 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 89.6 mt -70.81 -19.17 62.7 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.649 -178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.414 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 13.6 t70 -60.99 -37.15 81.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.982 0.42 . . . . 0.0 110.625 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 m -81.22 1.56 31.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.509 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 50.3 t -64.16 139.01 58.72 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.316 0.579 . . . . 0.0 111.916 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -129.4 43.67 3.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.358 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 95.26 -13.84 66.16 Favored Glycine 0 CA--C 1.521 0.424 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.791 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.88 97.12 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.762 0.315 . . . . 0.0 111.704 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.422 ' O ' ' HE1' ' A' ' 98' ' ' MET . 83.5 mt -112.61 -17.34 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.113 179.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.509 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 72.49 105.54 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.549 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -51.63 -52.51 47.19 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.361 0.581 . . . . 0.0 110.338 178.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 49.1 ptt85 -84.7 -0.32 53.14 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.651 177.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.41 -39.05 92.34 Favored Glycine 0 N--CA 1.46 0.276 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.87 -178.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.15 -45.41 12.08 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.787 0.327 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.78 -40.49 97.48 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -61.41 -41.16 96.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.011 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -64.47 -40.8 96.38 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.368 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.17 -44.13 72.86 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.911 0.386 . . . . 0.0 110.609 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.5 m -139.67 125.09 19.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.167 178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.3 m -109.36 111.22 22.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.508 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.8 m -143.1 143.92 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.197 178.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 62.7 p-90 -81.32 -11.26 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.21 -32.33 12.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.645 0.26 . . . . 0.0 111.484 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.528 ' HA ' ' CE1' ' A' ' 62' ' ' HIS . 99.0 m-20 -62.78 -38.65 91.45 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.435 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 32.5 m -64.76 -19.79 26.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -64.18 -46.36 84.32 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.695 0.283 . . . . 0.0 110.954 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.528 ' CE1' ' HA ' ' A' ' 59' ' ' ASP . 18.7 p-80 -85.68 -14.71 44.64 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.557 ' O ' ' HB3' ' A' ' 72' ' ' SER . 76.4 mt -59.8 -40.43 82.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 121.406 0.622 . . . . 0.0 109.518 178.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.517 ' O ' HG12 ' A' ' 67' ' ' VAL . 97.6 mt-10 -72.13 -21.33 61.48 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.601 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -73.85 -52.7 12.18 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 18.1 mt-10 -86.85 -3.51 59.08 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.2 p -57.36 -34.31 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.914 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -89.58 -4.52 57.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.07 0.462 . . . . 0.0 110.571 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -107.12 22.75 15.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.717 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.576 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 105.11 20.4 9.8 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.302 -0.951 . . . . 0.0 114.037 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.576 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 92.79 141.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.364 1.065 . . . . 0.0 112.155 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.557 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.2 t -130.18 -28.64 2.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.037 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.28 -64.49 4.34 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.072 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.446 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -87.68 -36.33 17.48 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.419 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.8 ttt180 -61.66 -47.98 82.89 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.622 -178.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 13.3 tm-20 -62.55 -40.71 97.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.62 0.248 . . . . 0.0 110.647 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.4 tp -60.55 -46.65 89.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.4 mt -70.37 -39.11 74.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.89 0.376 . . . . 0.0 111.721 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -78.35 -4.93 50.55 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.9 m -58.12 -40.16 80.54 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -86.54 -90.39 0.11 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.983 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.41 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . . . -108.3 -86.92 0.5 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' OE1' ' HB2' ' A' ' 82' ' ' ALA . 22.3 mp0 -110.6 -56.97 2.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.413 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 19.3 ttpp -132.54 -43.7 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.2 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 t30 48.03 35.74 5.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.702 0.801 . . . . 0.0 111.605 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.43 171.24 14.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.713 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.3 p -123.78 158.42 31.79 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.221 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -59.63 -41.28 84.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.268 -179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -39.8 98.14 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.815 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.47 -45.89 88.72 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.526 ' O ' HD12 ' A' ' 95' ' ' LEU . 0.3 OUTLIER -76.28 -24.88 54.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.456 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.5 tp -58.96 -41.3 87.17 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.177 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.13 -42.81 99.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.855 0.359 . . . . 0.0 110.956 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 79.5 t -70.52 -43.63 77.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.294 0.569 . . . . 0.0 110.696 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.526 HD12 ' O ' ' A' ' 91' ' ' LEU . 7.1 mp -61.83 -38.62 88.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.199 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -60.09 -39.98 88.02 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -62.77 -44.51 95.99 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.424 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.422 ' HE1' ' O ' ' A' ' 44' ' ' LEU . 90.4 mmm -69.87 -38.89 76.54 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 104.32 42.6 1.87 Allowed Glycine 0 CA--C 1.523 0.55 0 C-N-CA 119.79 -1.195 . . . . 0.0 113.291 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.482 ' ND1' ' HB3' ' A' ' 95' ' ' LEU . 26.8 p-80 -56.78 111.67 1.09 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.181 0.515 . . . . 0.0 112.355 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -85.4 -64.37 1.17 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -65.94 -35.87 81.79 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.043 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.557 -178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.52 ' O ' HG21 ' A' ' 107' ' ' ILE . 87.1 mt -60.13 -40.54 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 121.205 0.526 . . . . 0.0 109.878 178.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -59.45 -48.34 82.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.561 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.5 -25.46 28.82 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.52 HG21 ' O ' ' A' ' 104' ' ' ILE . 13.1 tt -61.59 -20.71 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 122.166 -0.334 . . . . 0.0 111.315 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.3 p -71.8 -10.15 59.35 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.384 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.93 -27.71 66.0 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 111.051 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.401 ' CE1' HD11 ' A' ' 25' ' ' LEU . 82.2 t80 -85.73 109.42 18.61 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.881 0.372 . . . . 0.0 110.072 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -144.33 22.87 2.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.73 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -149.19 158.96 44.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.577 0.227 . . . . 0.0 110.849 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.55 156.56 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.774 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 88.6 mt -117.07 141.52 48.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.617 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 51.1 m -108.51 112.73 60.67 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.78 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.63 64.59 8.11 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.572 2.181 . . . . 0.0 112.735 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.9 m -90.47 -4.87 56.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.7 mp0 -73.77 140.99 46.28 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -126.25 147.24 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.629 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 60.8 m -126.7 145.72 50.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.432 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.65 145.54 50.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.574 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -65.05 -39.38 93.21 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.387 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -127.56 146.45 50.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.431 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.207 0 CA-C-O 118.167 -1.352 . . . . 0.0 112.306 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.638 0.256 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 57.46 50.51 11.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.597 -0.728 . . . . 0.0 112.129 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -64.23 -39.32 93.71 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.37 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 83.02 4.09 90.14 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.821 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.5 m -62.94 -40.04 96.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.804 0.335 . . . . 0.0 111.519 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.0 ttp -88.1 78.18 8.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.038 0.446 . . . . 0.0 110.499 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.23 -40.96 97.11 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.47 179.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.57 165.45 40.39 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.643 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -159.2 150.8 20.44 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.1 m -122.02 145.63 47.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.769 0.318 . . . . 0.0 111.102 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 176.67 177.74 45.88 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.005 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.41 151.2 24.26 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -116.6 -70.43 0.79 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.743 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.09 156.7 28.82 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.616 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.77 93.02 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -107.63 148.6 29.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.7 p -80.12 110.62 15.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.098 0.475 . . . . 0.0 111.479 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 -10.04 46.66 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.103 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -104.35 21.74 16.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.564 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.1 m -66.88 114.98 6.14 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.747 0.308 . . . . 0.0 111.771 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.71 174.2 9.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.729 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.84 -57.63 3.56 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -72.24 -35.85 68.94 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.532 0.682 . . . . 0.0 110.808 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -111.85 69.96 0.7 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.243 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.404 ' CG ' ' HZ2' ' A' ' 84' ' ' LYS . 93.6 mt -46.34 156.02 0.52 Allowed Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.451 -179.54 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.53 163.5 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 124.854 3.703 . . . . 0.0 114.635 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.77 -8.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 124.386 3.39 . . . . 0.0 115.027 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.87 -35.85 64.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.919 0.327 . . . . 0.0 110.532 179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.423 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 5.9 tp -108.1 -78.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.546 HD12 ' SG ' ' A' ' 34' ' ' CYS . 46.1 tp -61.55 -47.35 85.94 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -177.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.89 -52.2 49.95 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.692 -0.766 . . . . 0.0 114.988 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 32.3 tp10 -72.71 -43.7 62.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.11 -40.72 94.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.435 -0.506 . . . . 0.0 112.324 -178.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.653 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 67.6 m -70.79 -43.84 67.86 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.45 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.75 -50.48 24.23 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.17 -43.38 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.563 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 84.7 mt -78.77 -15.9 57.85 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.626 -179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.653 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.4 t70 -58.77 -39.46 81.06 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.148 0.499 . . . . 0.0 110.8 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.5 m -90.53 10.03 27.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.023 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.1 t -68.13 142.43 55.76 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -137.92 57.66 1.71 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.178 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.46 -10.97 73.2 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.554 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.33 98.19 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.255 0.527 . . . . 0.0 111.019 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -126.14 -32.87 2.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.88 115.39 1.83 Allowed Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.625 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.6 p90 -54.38 -46.08 72.97 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.226 0.513 . . . . 0.0 110.846 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -83.49 -0.09 48.67 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 177.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.73 -47.65 89.19 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.297 -0.954 . . . . 0.0 113.465 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.3 mt -72.15 -42.66 65.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.055 0.427 . . . . 0.0 111.217 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.48 -39.87 92.45 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.19 -44.34 95.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.311 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -65.93 -40.5 91.46 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.026 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.8 -39.96 61.4 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 m -92.2 -169.65 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.016 0.436 . . . . 0.0 111.621 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 88.2 p -135.81 156.05 49.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.201 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t 70.85 164.77 0.28 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 123.792 0.683 . . . . 0.0 111.235 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.621 ' O ' HG21 ' A' ' 60' ' ' VAL . 32.1 m-90 -111.38 8.02 21.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.675 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 97.1 mt -70.79 -28.59 64.76 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.127 0.489 . . . . 0.0 111.175 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -65.25 -20.21 66.32 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.621 HG21 ' O ' ' A' ' 57' ' ' TRP . 16.1 m -61.35 -20.15 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -60.07 -47.89 83.97 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.585 0.231 . . . . 0.0 111.012 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.432 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.7 t60 -73.87 -28.25 61.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.632 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.614 ' O ' ' HB3' ' A' ' 72' ' ' SER . 85.2 mt -59.54 -41.55 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 121.289 0.566 . . . . 0.0 110.32 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.59 ' O ' HG13 ' A' ' 67' ' ' VAL . 80.9 mm-40 -67.09 -34.96 78.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 178.491 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.4 mttt -62.53 -49.21 76.24 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -177.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.518 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.2 mt-10 -89.47 -3.64 58.29 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.59 HG13 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -54.86 -28.7 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 118.116 0.416 . . . . 0.0 111.502 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.68 -4.73 58.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 111.179 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -106.47 22.32 16.0 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.895 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.717 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 12.01 30.72 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-O 118.567 -1.129 . . . . 0.0 113.605 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.717 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.8 tppp? 108.34 149.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.97 1.308 . . . . 0.0 112.227 177.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.614 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -134.36 -19.79 1.9 Allowed 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.495 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -60.78 -67.76 1.98 Allowed Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.605 -1.283 . . . . 0.0 111.72 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.403 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 6.2 m -88.11 -33.85 18.11 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.508 -0.407 . . . . 0.0 111.057 179.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -61.44 -45.74 93.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.839 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.484 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.9 tt0 -61.68 -41.57 97.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.602 0.239 . . . . 0.0 110.477 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 65.1 tp -61.76 -46.24 90.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 89.5 mt -67.69 -39.23 84.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.872 0.368 . . . . 0.0 111.145 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -80.96 -4.94 56.75 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.2 m -58.45 -40.05 81.58 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -86.26 -89.61 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -86.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.121 0.486 . . . . 0.0 109.745 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -114.29 -54.64 2.57 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.423 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 18.5 ttpp -132.26 -43.9 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.6 t30 47.41 34.87 3.57 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.826 0.85 . . . . 0.0 111.703 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.29 170.79 15.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.648 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.0 p -122.86 158.6 29.94 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.036 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.39 -38.18 73.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.08 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.57 98.13 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.104 -0.57 . . . . 0.0 112.756 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.22 -46.43 87.03 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.469 ' O ' HG21 ' A' ' 94' ' ' VAL . 1.1 mm? -74.18 -24.13 59.33 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.154 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.6 tp -59.16 -37.66 77.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.061 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.0 -41.69 97.02 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.836 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.469 HG21 ' O ' ' A' ' 91' ' ' LEU . 16.8 m -83.65 -23.26 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.183 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.435 HD12 ' O ' ' A' ' 91' ' ' LEU . 1.6 mp -63.42 -41.09 98.7 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 109.843 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.77 -37.75 87.17 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.558 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -61.65 -40.52 95.2 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.68 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.4 mmt -89.42 -12.97 38.73 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.608 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.83 37.97 65.83 Favored Glycine 0 CA--C 1.52 0.401 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.748 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.595 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 19.3 t-160 -78.05 95.29 4.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.318 0.559 . . . . 0.0 110.218 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.63 -40.86 96.21 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.096 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -61.19 -39.89 91.89 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.688 0.28 . . . . 0.0 111.291 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.595 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -61.31 -38.78 88.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.397 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.583 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -62.15 -42.95 97.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.953 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.516 ' O ' HG22 ' A' ' 108' ' ' THR . 83.7 m-70 -63.38 -40.8 98.22 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.434 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -84.16 -21.77 31.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.7 tp -61.72 -21.0 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 120.696 0.284 . . . . 0.0 111.514 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 105' ' ' HIS . 7.5 t -67.86 -13.94 62.55 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -74.29 -10.82 59.97 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 111.665 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -66.59 138.67 57.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.033 0.444 . . . . 0.0 111.143 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.33 14.87 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.695 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.96 -39.47 92.23 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.816 0.341 . . . . 0.0 111.666 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.403 ' O ' ' HB2' ' A' ' 114' ' ' LEU . 30.3 m -74.56 -17.59 16.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.029 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 113' ' ' VAL . 83.7 mt 70.88 -55.71 0.64 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.43 0.692 . . . . 0.0 112.168 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.0 m -120.01 97.38 49.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.537 0.208 . . . . 0.0 111.439 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -72.72 157.01 52.79 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.656 2.237 . . . . 0.0 112.236 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.6 p -64.59 -34.34 78.03 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.826 0.346 . . . . 0.0 111.664 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -119.76 144.71 47.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 57.65 41.53 25.33 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.734 0.646 . . . . 0.0 111.545 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 91.7 p -74.79 162.0 29.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.155 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -120.87 127.98 52.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.594 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -125.82 144.69 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -112.67 126.74 55.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.517 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.972 0 CA-C-O 118.507 -1.163 . . . . 0.0 112.303 -179.951 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.551 0.215 . . . . 0.0 110.815 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 59.0 47.35 12.27 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.11 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -146.52 160.65 41.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.433 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.98 2.39 90.67 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.886 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.2 m -85.85 73.42 10.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.982 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 39.1 mmt -84.52 141.2 30.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.807 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -71.14 139.38 50.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.188 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.95 -175.4 42.55 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.551 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.94 130.87 44.98 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 74.3 m 65.34 20.34 11.81 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.697 0.623 . . . . 0.0 111.559 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.74 -41.55 98.89 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.346 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.81 156.98 35.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.612 0.244 . . . . 0.0 111.114 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.43 158.47 42.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.518 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.52 164.6 33.28 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.075 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.57 -89.19 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.004 0.522 . . . . 0.0 111.749 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.43 160.65 16.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.591 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.414 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 1.7 p -72.64 108.53 5.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.065 0.459 . . . . 0.0 110.586 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.95 -6.5 53.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.996 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.515 ' NE2' ' HA ' ' A' ' 10' ' ' CYS . 79.8 m80 -104.47 21.53 16.55 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.203 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.4 m -76.42 122.6 24.75 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.29 166.88 20.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.438 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.5 tp -63.66 -49.81 71.76 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.84 -33.73 22.81 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.344 0.593 . . . . 0.0 111.292 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.3 72.47 0.78 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.529 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.2 mt -46.73 156.83 0.5 Allowed Pre-proline 0 CA--C 1.541 0.599 0 O-C-N 123.415 0.447 . . . . 0.0 111.282 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -37.78 162.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.364 1.342 0 C-N-CA 124.877 3.718 . . . . 0.0 115.126 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 87.7 Cg_exo -49.13 -9.35 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 124.338 3.359 . . . . 0.0 115.11 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.38 -35.02 62.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.825 0.284 . . . . 0.0 110.998 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.502 ' HB3' ' HE3' ' A' ' 84' ' ' LYS . 4.1 tp -108.49 -78.28 0.59 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.66 -48.44 80.79 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.9 -51.74 56.72 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.645 -0.788 . . . . 0.0 114.249 -178.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.47 ' OE2' HG21 ' A' ' 36' ' ' VAL . 46.3 tp10 -70.21 -44.03 69.47 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -68.39 -39.0 81.84 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.4 p -71.82 -30.93 66.01 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.689 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.14 -56.76 3.38 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.47 HG21 ' OE2' ' A' ' 32' ' ' GLU . 54.5 t -64.69 -44.71 96.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.07 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.85 -18.04 61.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.607 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.448 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 12.7 t70 -58.41 -38.56 77.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 110.755 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.5 m -90.39 7.72 37.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.095 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.0 t -65.75 140.63 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.229 0.537 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -135.46 54.61 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.145 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.66 -10.58 73.8 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 115.692 -0.685 . . . . 0.0 113.607 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.52 98.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 117.255 0.528 . . . . 0.0 111.007 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -123.4 -26.63 4.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.76 114.86 0.83 Allowed Glycine 0 N--CA 1.444 -0.78 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.755 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.405 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 p90 -53.58 -46.47 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.191 0.495 . . . . 0.0 110.403 178.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.8 ptt85 -83.75 1.33 43.32 Favored 'General case' 0 C--O 1.213 -0.865 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.797 177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.9 -44.86 94.22 Favored Glycine 0 C--O 1.23 -0.134 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.252 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -72.88 -43.51 62.42 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.036 0.418 . . . . 0.0 111.194 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.543 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -65.37 -39.55 92.42 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.48 -42.87 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.048 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -41.79 99.35 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.544 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 52.1 tp -67.76 -40.14 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.604 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.3 m 58.62 50.94 8.34 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.147 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p -63.75 -37.77 88.61 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.735 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.3 t -155.72 146.16 21.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.735 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -70.28 -31.29 68.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.47 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.5 mt -88.28 0.07 56.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.675 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.415 ' O ' HG13 ' A' ' 63' ' ' ILE . 36.8 t70 -61.13 -39.45 90.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.521 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.488 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 15.9 m -61.35 -27.92 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.26 -39.71 95.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 0.0 111.24 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.418 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 15.0 t60 -84.04 -18.38 37.21 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.24 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.491 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -60.41 -41.49 87.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.089 0.471 . . . . 0.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.584 ' O ' HG11 ' A' ' 67' ' ' VAL . 99.0 mt-10 -64.64 -38.68 91.84 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 33.5 mttm -65.89 -46.15 79.43 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -177.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.512 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.98 -3.81 57.8 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.584 HG11 ' O ' ' A' ' 64' ' ' GLU . 8.3 p -56.11 -35.59 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-N 118.18 0.446 . . . . 0.0 111.392 -179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.36 -4.62 58.0 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.966 0.412 . . . . 0.0 110.862 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -104.83 22.21 15.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.869 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.54 21.48 9.22 Favored Glycine 0 CA--C 1.52 0.375 0 C-N-CA 120.409 -0.901 . . . . 0.0 114.191 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.31 141.13 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.302 1.041 . . . . 0.0 112.004 177.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.6 t -130.73 -30.74 1.82 Allowed 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.236 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.543 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -54.65 -64.33 4.43 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.309 -0.948 . . . . 0.0 112.316 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.455 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 22.8 m -87.74 -38.53 15.71 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 122.725 -0.279 . . . . 0.0 111.692 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.416 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.5 ttt180 -60.54 -48.36 82.13 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.535 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -63.29 -39.68 95.24 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.772 0.32 . . . . 0.0 110.677 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.08 -46.85 88.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.559 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 88.2 mt -71.31 -39.13 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.1 0.476 . . . . 0.0 111.19 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -76.25 -7.03 53.99 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -178.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.7 p -57.66 -38.94 75.94 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 m95 -87.62 -89.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.484 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -87.22 0.49 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -115.63 -52.37 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.502 ' HE3' ' HB3' ' A' ' 29' ' ' LEU . 1.5 ttpm? -132.25 -44.75 0.93 Allowed 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.0 t30 47.09 35.85 3.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.503 0.721 . . . . 0.0 111.307 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.32 16.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.986 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 61.9 p -119.27 155.24 32.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.68 -39.72 80.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.608 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.93 -39.21 97.24 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.743 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.17 -45.84 89.94 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.68 -23.88 53.19 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 62.8 tp -59.01 -41.65 88.25 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.037 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.2 -41.25 98.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.606 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.17 -40.25 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.174 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.62 -36.94 82.19 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.27 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -60.92 -39.68 90.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.854 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -63.44 -44.2 95.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.936 0.398 . . . . 0.0 110.408 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 37.4 mmt -68.87 -36.56 78.25 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.956 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.53 30.17 27.93 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.525 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.494 ' CD2' ' HB1' ' A' ' 103' ' ' ALA . 0.8 OUTLIER -74.41 97.33 3.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.147 0.498 . . . . 0.0 110.927 -179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.33 -41.66 96.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.663 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . 0.4 ' HB3' ' CE1' ' A' ' 100' ' ' HIS . 25.8 tpp180 -62.16 -41.33 98.2 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.901 0.381 . . . . 0.0 110.872 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.93 -39.11 88.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.24 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.589 ' O ' HG22 ' A' ' 107' ' ' ILE . 41.2 mm -62.41 -43.67 98.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.794 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -63.55 -42.08 98.41 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -22.96 31.35 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 104' ' ' ILE . 8.6 tt -66.09 -20.54 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 120.84 0.353 . . . . 0.0 111.429 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.1 p -70.47 -10.94 60.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.836 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -69.87 -26.33 64.14 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 0.0 110.917 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -68.28 127.54 33.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -159.48 52.26 0.38 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.98 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -146.95 152.97 39.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.593 0.196 . . . . 0.0 110.541 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.5 t -99.64 91.75 2.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.083 0.468 . . . . 0.0 110.538 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 91.6 mt -128.77 135.66 49.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.239 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -127.12 116.08 21.82 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.79 -0.186 . . . . 0.0 110.94 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.04 147.57 54.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.465 2.11 . . . . 0.0 112.123 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.9 m -131.11 144.19 51.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.773 0.321 . . . . 0.0 111.2 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -132.02 148.09 52.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.273 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -114.91 126.14 54.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.751 0.31 . . . . 0.0 110.444 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.2 m -127.16 145.76 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.517 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -68.33 -37.75 80.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.902 0.382 . . . . 0.0 110.985 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -152.28 159.37 43.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.311 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 59.5 -106.13 0.27 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.623 0.577 . . . . 0.0 111.377 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.15 -1.361 . . . . 0.0 112.273 -179.928 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.825 0.345 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 58.01 46.46 16.37 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.995 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -74.01 144.9 44.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.07 -173.39 41.7 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.275 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.8 t -107.32 125.39 51.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.695 0.283 . . . . 0.0 110.47 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.9 mtp -88.33 69.54 9.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.024 0.44 . . . . 0.0 111.009 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.27 149.37 32.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.373 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.32 4.86 90.03 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.625 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -71.1 143.87 50.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.806 0.336 . . . . 0.0 110.806 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.6 p -150.13 165.67 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.54 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.14 91.44 1.65 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.603 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.59 152.01 37.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.322 0.106 . . . . 0.0 110.773 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? 57.19 44.71 21.79 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.653 0.596 . . . . 0.0 111.812 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.71 4.22 72.12 Favored Glycine 0 CA--C 1.52 0.352 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.753 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -162.35 0.85 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.696 0.284 . . . . 0.0 110.999 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.67 159.74 29.41 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.822 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.6 p -73.48 110.0 7.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.897 0.38 . . . . 0.0 111.736 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.19 -7.96 49.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.348 0.594 . . . . 0.0 110.476 178.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -106.89 21.23 17.86 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.356 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 t -70.37 114.14 8.2 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -163.7 175.03 10.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.6 178.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mp -80.31 -57.87 3.4 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -71.51 -36.13 70.97 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.623 0.725 . . . . 0.0 110.589 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -112.42 69.76 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.334 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.43 ' CG ' ' HZ1' ' A' ' 84' ' ' LYS . 83.8 mt -47.14 157.46 0.5 Allowed Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.824 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -39.71 165.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 124.86 3.707 . . . . 0.0 114.182 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.412 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 77.6 Cg_exo -49.85 -9.36 0.15 Allowed 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.932 3.088 . . . . 0.0 114.979 -178.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.18 -35.29 67.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.773 0.26 . . . . 0.0 110.933 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.552 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 8.1 tp -107.88 -77.8 0.59 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -49.38 73.73 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -59.76 -51.79 56.85 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 -177.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -71.28 -43.49 67.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.41 ' CD1' HD12 ' A' ' 29' ' ' LEU . 83.8 mt -67.86 -38.86 83.62 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -178.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.8 p -74.18 -32.1 62.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.822 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.96 -56.33 3.53 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.429 HG12 ' NE2' ' A' ' 100' ' ' HIS . 69.3 t -64.43 -45.25 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.8 -17.9 61.53 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.056 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.494 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.0 t70 -59.22 -37.79 78.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.979 0.419 . . . . 0.0 110.892 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.6 m -86.98 6.51 31.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.193 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.458 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 41.9 t -65.14 142.03 58.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.206 0.527 . . . . 0.0 111.458 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -131.42 46.19 2.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.155 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.12 -11.79 71.2 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.637 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.16 -43.32 98.6 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.099 0.476 . . . . 0.0 111.059 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -114.67 -24.89 8.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.296 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.458 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.76 113.96 0.26 Allowed Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.222 -178.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.5 p90 -53.03 -46.01 68.24 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 117.429 0.614 . . . . 0.0 110.388 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 45.3 ptt85 -84.01 1.3 44.46 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.012 177.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.77 -50.87 60.54 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.952 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.86 -41.87 67.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.281 0.54 . . . . 0.0 111.302 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.52 94.6 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -59.92 -44.11 94.51 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.19 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.039 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.3 tt -69.25 -43.83 73.17 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.94 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.4 t -155.87 139.73 16.23 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.752 0.31 . . . . 0.0 110.659 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.6 m -122.16 129.77 52.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.86 0.362 . . . . 0.0 111.272 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -157.29 141.95 16.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.899 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.8 m0 -64.49 -40.41 95.61 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.899 0.38 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.26 -39.57 82.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.055 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.433 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.1 t70 -63.77 -45.97 87.37 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.568 -179.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.427 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 27.5 m -68.06 -26.59 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -178.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -63.86 -44.12 94.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.886 0.374 . . . . 0.0 110.59 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -73.55 -24.95 60.18 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.287 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.539 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.19 -40.27 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.198 0.523 . . . . 0.0 110.678 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.435 ' O ' HG13 ' A' ' 67' ' ' VAL . 79.4 mm-40 -69.77 -20.67 63.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.571 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.91 -52.49 8.77 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.495 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 3.7 mt-10 -86.48 -3.38 59.0 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 64' ' ' GLU . 8.2 p -55.52 -34.81 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 117.947 0.34 . . . . 0.0 111.134 179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.14 -4.59 58.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.774 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -105.12 21.94 16.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.614 -178.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.5 22.79 8.33 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 114.223 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.93 139.05 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.389 1.076 . . . . 0.0 112.17 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.539 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -131.4 -20.79 2.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.696 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -60.65 -67.57 2.07 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.832 -1.175 . . . . 0.0 111.669 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 10.7 m -87.78 -35.03 18.09 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 122.612 -0.346 . . . . 0.0 111.573 179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.2 ttt180 -60.86 -47.76 84.89 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.496 -177.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.9 tt0 -62.5 -40.51 96.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.689 0.281 . . . . 0.0 110.908 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 63.3 tp -62.0 -47.15 86.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.834 179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 95.2 mt -71.05 -39.85 72.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.056 0.455 . . . . 0.0 111.483 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 26.2 t-105 -77.83 -6.89 55.66 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.368 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -58.59 -42.16 87.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 60.1 m95 -85.63 -89.09 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.08 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.93 -86.59 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.176 0.512 . . . . 0.0 109.725 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -113.98 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.552 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 20.7 ttpp -131.92 -43.97 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.005 175.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.3 t30 48.09 31.48 2.52 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.099 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.27 169.51 17.64 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 78.4 p -127.28 160.07 32.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.479 HD11 HD11 ' A' ' 29' ' ' LEU . 4.4 mm -59.44 -38.64 76.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.151 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.18 96.61 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.628 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -66.42 -43.84 84.6 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.819 0.343 . . . . 0.0 111.09 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.58 HD12 ' O ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -74.5 -29.1 61.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.42 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.05 -41.03 82.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.05 -43.19 99.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.976 0.417 . . . . 0.0 110.616 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 84.6 t -70.87 -41.17 77.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.527 0.68 . . . . 0.0 110.227 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.403 HD13 ' CB ' ' A' ' 103' ' ' ALA . 61.0 tp -60.82 -40.95 94.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.06 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.95 -39.56 89.97 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.951 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -64.5 -43.29 94.59 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.564 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 54.0 tpp -69.25 -39.99 78.14 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.182 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.48 40.31 23.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.792 -0.718 . . . . 0.0 114.687 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.429 ' NE2' HG12 ' A' ' 36' ' ' VAL . 9.4 t60 -80.92 112.83 18.67 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.631 0.715 . . . . 0.0 110.227 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.9 mmm180 -64.06 -42.44 97.01 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -62.23 -39.67 93.58 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.1 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.403 ' CB ' HD13 ' A' ' 95' ' ' LEU . . . -60.49 -38.46 84.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.528 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.575 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.4 mt -61.32 -43.16 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.455 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.541 ' O ' HG22 ' A' ' 108' ' ' THR . 85.6 m-70 -64.84 -39.46 93.6 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.86 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.85 -30.42 28.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.575 HG22 ' O ' ' A' ' 104' ' ' ILE . 13.6 tt -62.54 -22.67 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . 0.541 HG22 ' O ' ' A' ' 105' ' ' HIS . 6.0 t -68.77 -6.73 28.33 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -89.02 3.2 52.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 111.457 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -95.14 120.7 35.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 0.0 109.989 179.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -134.23 32.11 2.69 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.44 -0.886 . . . . 0.0 113.279 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.88 133.02 40.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.962 0.381 . . . . 0.0 111.101 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.9 m -100.95 3.74 10.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.957 0.408 . . . . 0.0 111.493 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.6 mt -112.45 144.2 42.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.4 m -122.59 86.86 49.25 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.738 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -81.58 64.92 8.68 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.83 2.353 . . . . 0.0 113.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 65.1 m -101.01 137.46 39.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.024 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -127.29 155.08 44.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.348 . . . . 0.0 111.258 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.2 pttm -143.39 157.41 44.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.096 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.5 m -130.03 149.65 51.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.926 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -120.04 127.97 53.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.199 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -124.79 144.64 50.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.34 -39.3 93.62 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.451 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.498 -1.168 . . . . 0.0 112.086 179.97 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 121.102 0.477 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -106.6 126.69 52.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.303 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -126.94 150.35 49.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.559 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.29 -176.81 38.97 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.026 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.4 m 72.51 -57.09 0.64 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.341 0.656 . . . . 0.0 111.959 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.1 mtp 55.52 51.37 12.86 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.981 0.419 . . . . 0.0 111.568 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -135.41 153.01 51.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.917 -179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.0 -174.13 42.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.181 -0.533 . . . . 0.0 111.961 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -137.84 145.52 42.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.75 0.275 . . . . 0.0 111.039 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.6 t -69.04 129.75 40.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 162.54 21.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.429 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.44 154.69 42.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.558 0.218 . . . . 0.0 110.587 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -120.27 130.36 54.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.892 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.11 158.14 39.9 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.91 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.92 95.77 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 111.908 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.24 145.35 25.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.515 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 p -79.63 108.44 13.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.962 0.41 . . . . 0.0 111.409 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.73 -11.81 32.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.447 0.641 . . . . 0.0 110.972 178.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -105.34 21.7 16.71 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.481 -178.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.3 t -81.9 119.27 23.72 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.47 172.02 19.09 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.4 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.6 tp -63.22 -50.34 70.63 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -178.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -91.48 -35.5 14.29 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.449 0.642 . . . . 0.0 110.904 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.79 71.0 1.04 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.082 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.466 HD13 ' CE1' ' A' ' 110' ' ' TYR . 93.6 mt -47.57 156.33 0.67 Allowed Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.717 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -39.33 165.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 125.068 3.846 . . . . 0.0 114.716 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.26 -8.78 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.296 3.331 . . . . 0.0 115.347 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.29 -36.4 66.12 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.118 0.417 . . . . 0.0 110.456 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.433 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -107.76 -77.93 0.59 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -52.55 65.0 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.475 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -59.76 -49.45 78.41 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.684 -0.77 . . . . 0.0 114.683 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -70.94 -44.22 66.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.47 -38.89 81.48 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -74.08 -32.13 63.13 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.889 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.91 -55.25 4.05 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 66.3 t -64.51 -45.21 96.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.75 -19.18 61.42 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.926 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 42.9 t0 -60.31 -36.12 77.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.0 m -86.11 5.76 32.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.183 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.535 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 51.4 t -65.36 142.19 58.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.399 0.619 . . . . 0.0 111.926 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -130.88 40.32 3.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.582 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 96.12 -15.46 62.92 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.023 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.18 97.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.931 0.365 . . . . 0.0 111.749 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.525 ' HG ' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -108.47 -22.99 12.06 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.173 0.511 . . . . 0.0 109.997 179.142 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.535 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 76.95 107.61 0.15 Allowed Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.25 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.2 p90 -52.71 -48.47 66.59 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.312 0.556 . . . . 0.0 110.31 178.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -84.17 0.01 50.35 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.599 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.44 -41.76 95.45 Favored Glycine 0 C--N 1.329 0.164 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.45 -177.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 92.7 mt -84.05 -43.02 15.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.04 0.42 . . . . 0.0 111.186 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.96 94.6 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.591 0.959 . . . . 0.0 113.591 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -60.58 -43.7 97.05 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.147 0.279 . . . . 0.0 111.302 -178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -65.39 -39.37 92.14 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.588 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 tt -69.34 -45.66 68.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.762 0.315 . . . . 0.0 110.979 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.1 m -142.45 132.55 24.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.013 179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.6 m -114.84 122.4 46.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.9 m -136.68 148.75 47.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.092 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.465 ' CD1' ' HG ' ' A' ' 58' ' ' LEU . 69.2 t-105 -95.48 140.0 30.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.535 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.465 ' HG ' ' CD1' ' A' ' 57' ' ' TRP . 81.5 mt 75.99 -30.1 0.19 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.718 0.807 . . . . 0.0 112.361 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -66.58 -21.19 66.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.706 0.289 . . . . 0.0 111.235 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 25.4 m -63.07 -20.18 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.777 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.13 -41.21 99.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.616 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -66.65 -26.7 67.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.917 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.529 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.53 -41.87 86.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.342 0.592 . . . . 0.0 109.914 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.596 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.38 -34.79 75.08 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.42 178.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.12 -47.7 83.44 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.577 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 61.8 mm-40 -89.36 -3.38 58.48 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -55.77 -33.59 34.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.294 0.497 . . . . 0.0 111.268 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.61 -4.61 57.74 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.899 0.38 . . . . 0.0 110.721 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -108.53 22.82 15.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.196 -178.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.629 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.74 16.04 18.65 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.169 -1.015 . . . . 0.0 114.734 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 97.83 143.73 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.491 1.116 . . . . 0.0 111.975 177.26 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.577 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.2 t -132.09 -27.81 1.79 Allowed 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.495 178.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.34 2.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 119.962 -1.113 . . . . 0.0 112.204 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.8 m -87.24 -35.96 18.21 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.774 -0.251 . . . . 0.0 111.535 179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -60.57 -46.73 89.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.874 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.4 tt0 -62.08 -42.81 99.59 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.476 0.179 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 tp -61.57 -46.42 89.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.463 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 98.3 mt -67.33 -39.54 85.83 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.486 -179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -80.26 -5.54 56.39 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.5 m -59.07 -40.01 83.87 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -86.4 -90.61 0.11 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.18 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.33 -87.28 0.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 109.717 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -110.47 -56.91 2.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.433 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 17.4 ttpp -132.5 -43.36 0.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.206 176.446 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 48.51 34.32 4.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.891 0.876 . . . . 0.0 111.883 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.404 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.22 169.3 18.03 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.2 p -125.28 158.62 33.69 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.717 179.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.87 -40.06 81.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.792 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.5 -40.17 98.32 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.733 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.27 -40.79 96.7 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 95' ' ' LEU . 0.2 OUTLIER -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.259 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.16 -40.1 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.113 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -61.7 -41.35 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.906 0.384 . . . . 0.0 110.482 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.2 t -69.32 -41.17 80.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.282 0.563 . . . . 0.0 110.022 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.527 HD12 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -59.06 -36.85 75.74 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.704 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.84 -39.35 94.12 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.353 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -61.9 -47.37 85.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.65 0.262 . . . . 0.0 110.657 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.2 mmm -71.21 -36.22 71.79 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.36 33.06 36.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.331 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.525 ' NE2' ' HG ' ' A' ' 44' ' ' LEU . 32.9 t-80 -66.8 108.25 2.46 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.524 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -63.75 -44.74 92.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -64.39 -41.4 96.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.006 0.432 . . . . 0.0 111.044 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.502 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.91 -40.3 92.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.806 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.595 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -62.72 -45.1 99.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.99 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -65.96 -40.54 91.38 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.03 -22.37 33.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.595 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.9 tp -66.41 -20.79 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.753 0.311 . . . . 0.0 111.161 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.3 p -70.5 -10.25 58.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.934 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -69.92 -26.24 64.05 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.865 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.466 ' CE1' HD13 ' A' ' 25' ' ' LEU . 82.1 t80 -70.78 129.22 38.53 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.266 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -72.2 146.06 38.78 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.192 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.429 ' O ' ' HB ' ' A' ' 113' ' ' VAL . . . -95.01 156.48 16.3 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.021 -0.105 . . . . 0.0 110.973 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.429 ' HB ' ' O ' ' A' ' 112' ' ' ALA . 88.5 t 76.42 139.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 123.887 0.742 . . . . 0.0 111.116 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.408 ' N ' HG13 ' A' ' 113' ' ' VAL . 87.5 mt 64.38 39.98 6.74 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.208 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.7 m -72.06 133.35 83.83 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.64 61.54 6.17 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.788 2.325 . . . . 0.0 113.163 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 97.1 p -82.97 -11.28 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.739 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -128.33 156.34 43.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -65.79 -20.48 66.27 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.595 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 68.6 m -61.49 -38.11 86.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.337 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -71.89 141.11 49.54 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -150.02 160.16 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 59.94 -111.17 0.5 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.662 0.601 . . . . 0.0 111.253 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.149 -1.362 . . . . 0.0 112.195 -179.952 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 120.912 0.387 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -118.55 134.27 55.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -63.59 -45.89 88.32 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 166.22 38.0 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.956 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.481 ' HA ' HH11 ' A' ' 101' ' ' ARG . 62.3 m -132.74 103.95 6.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.602 0.239 . . . . 0.0 110.958 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.4 mmt -134.56 152.86 52.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.772 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.53 136.56 54.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.748 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 177.55 -179.49 48.19 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.01 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -133.81 103.92 6.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.816 0.341 . . . . 0.0 110.923 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.0 m -130.93 157.83 41.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.347 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.72 143.85 15.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.807 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.4 148.34 43.43 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.501 0.191 . . . . 0.0 111.16 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.88 -24.91 62.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.57 178.1 48.5 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.88 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -98.38 -36.69 9.89 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.4 mt -102.68 138.99 38.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.405 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 2.8 p -80.82 108.64 14.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.237 0.541 . . . . 0.0 112.229 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.16 -9.82 41.05 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.884 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -102.77 21.72 14.99 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.889 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -72.1 121.0 18.51 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.19 160.35 11.61 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.0 tp -65.85 -51.03 62.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -76.09 -36.73 58.82 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.457 0.646 . . . . 0.0 111.242 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.88 70.9 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.836 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.6 mt -45.43 154.43 0.51 Allowed Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 123.869 0.731 . . . . 0.0 111.848 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -38.04 163.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 125.12 3.88 . . . . 0.0 115.075 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.405 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 85.1 Cg_exo -48.76 -9.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.415 3.41 . . . . 0.0 115.177 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.408 ' CB ' ' HA ' ' A' ' 107' ' ' ILE . . . -53.86 -35.29 61.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.784 0.265 . . . . 0.0 110.5 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.508 ' HB3' ' HE3' ' A' ' 84' ' ' LYS . 3.0 tp -108.03 -77.3 0.6 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.197 0.444 . . . . 0.0 112.197 178.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.451 ' HB2' ' HZ2' ' A' ' 84' ' ' LYS . 0.8 OUTLIER -59.89 -53.98 51.54 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -177.867 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.68 -51.75 57.12 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.63 -0.795 . . . . 0.0 115.045 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.491 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 35.8 tp10 -71.3 -43.06 67.82 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.44 -39.32 85.38 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.614 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.4 p -71.46 -29.2 64.58 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.474 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.55 -55.8 3.82 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.8 t -64.14 -44.93 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.51 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 88.6 mt -77.56 -16.8 58.42 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 122.068 -0.395 . . . . 0.0 111.846 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.614 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 32.5 t70 -59.34 -39.59 83.65 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.134 0.493 . . . . 0.0 110.556 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -93.27 11.42 28.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.003 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 t -67.86 144.68 55.19 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.015 0.436 . . . . 0.0 111.199 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -136.59 54.89 1.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.92 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.07 -12.94 68.85 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.035 -0.602 . . . . 0.0 114.095 178.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.99 98.75 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.564 0.682 . . . . 0.0 110.894 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.519 ' O ' ' HE1' ' A' ' 98' ' ' MET . 85.3 mt -125.38 -30.63 3.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.569 178.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.5 117.3 0.74 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.237 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.444 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 27.6 p90 -56.24 -42.81 77.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 117.043 0.421 . . . . 0.0 110.743 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.407 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 0.0 OUTLIER -84.27 -0.35 52.01 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.671 178.193 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.87 -45.65 94.72 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.548 -0.834 . . . . 0.0 113.235 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.5 mt -72.21 -43.32 64.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.887 0.343 . . . . 0.0 111.262 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.563 ' HB3' ' O ' ' A' ' 73' ' ' GLY . . . -65.4 -41.64 93.45 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -61.71 -43.79 98.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.305 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -65.09 -40.33 94.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.723 ' O ' ' HB2' ' A' ' 54' ' ' SER . 59.7 tp -66.81 -47.13 72.99 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.447 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.723 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 0.1 OUTLIER 149.22 93.34 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.452 1.095 . . . . 0.0 110.714 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.0 p -84.37 -12.57 54.28 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.816 0.341 . . . . 0.0 110.98 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.8 m 61.19 16.14 6.97 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.155 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 17.2 m-90 53.73 24.78 4.56 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.12 0.568 . . . . 0.0 112.335 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.4 tp -128.57 -42.67 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.122 0.487 . . . . 0.0 110.476 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -65.93 -20.45 66.22 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.615 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.453 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 16.4 m -58.26 -31.1 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.57 -40.85 98.02 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.927 0.394 . . . . 0.0 110.329 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -76.29 -24.07 54.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.719 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.511 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.0 mt -59.85 -43.6 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.124 0.488 . . . . 0.0 110.294 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.569 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.7 mt-10 -67.39 -36.24 80.9 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.931 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.85 -49.06 76.38 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.538 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.9 mt-10 -90.08 -4.17 57.51 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.569 HG11 ' O ' ' A' ' 64' ' ' GLU . 5.2 p -56.44 -33.71 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.364 0.529 . . . . 0.0 111.226 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.38 -4.25 58.12 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 110.803 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -106.97 22.13 16.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.026 -178.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.65 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.41 20.94 9.7 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.275 -0.964 . . . . 0.0 114.124 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.65 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.2 tppp? 95.72 147.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.447 1.099 . . . . 0.0 112.082 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.538 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.5 t -138.29 -30.91 0.77 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.54 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.563 ' O ' ' HB3' ' A' ' 50' ' ' ALA . . . -52.88 -66.95 2.36 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.279 -0.963 . . . . 0.0 112.708 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.3 m -87.8 -34.45 18.28 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 122.441 -0.447 . . . . 0.0 111.113 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -60.9 -48.37 82.12 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.812 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.0 tt0 -63.15 -41.19 99.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.641 0.258 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.2 tp -60.89 -47.23 87.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.781 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.6 mt -70.34 -38.51 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.113 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -76.64 -6.62 52.83 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 64.6 m -58.87 -40.29 83.92 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -86.5 -90.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.786 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.438 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . . . -108.26 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.438 ' OE1' ' HB2' ' A' ' 82' ' ' ALA . 22.7 mp0 -112.41 -55.98 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.093 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 29' ' ' LEU . 1.2 ttpm? -132.31 -43.75 0.94 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.1 t30 47.76 36.02 5.3 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.752 0.821 . . . . 0.0 111.269 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.0 170.85 15.23 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.802 -178.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.5 p -117.99 155.38 30.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.037 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.14 -39.3 78.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.873 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.8 -39.02 97.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.027 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -62.26 -46.63 87.95 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.98 -23.88 55.35 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.178 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.21 -39.46 82.72 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.027 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 53.3 mt-30 -61.22 -42.16 98.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.04 0.448 . . . . 0.0 110.47 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 99.7 t -71.75 -40.15 69.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.391 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 86.2 mt -61.64 -41.08 97.01 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.209 -179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 16.6 pt20 -68.67 -28.14 66.61 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.41 -48.83 73.89 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 0.519 ' HE1' ' O ' ' A' ' 44' ' ' LEU . 88.7 mmm -71.76 -36.72 70.47 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.437 178.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.48 40.41 3.43 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.947 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.473 ' CG ' ' HB1' ' A' ' 103' ' ' ALA . 2.5 t-80 -73.87 88.57 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.987 0.422 . . . . 0.0 111.578 -179.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.481 HH11 ' HA ' ' A' ' 5' ' ' SER . 19.4 mmt85 -62.76 -43.25 99.28 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.3 tpm_? -63.22 -40.01 96.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.819 0.342 . . . . 0.0 111.106 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.48 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.78 -38.27 87.42 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.602 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.593 ' O ' HG22 ' A' ' 107' ' ' ILE . 94.6 mt -61.39 -44.29 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -65.08 -40.78 95.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.581 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.491 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -81.07 -22.39 39.26 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.502 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.593 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.5 tp -63.18 -20.97 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.863 0.363 . . . . 0.0 111.08 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.8 p -73.02 -13.18 61.17 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.621 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.424 ' OD1' HD21 ' A' ' 106' ' ' LEU . 18.3 m120 -74.33 -10.03 59.18 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -63.12 129.26 39.56 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.89 135.21 15.71 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.932 -179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -85.69 -3.29 58.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.689 0.28 . . . . 0.0 111.532 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.09 -45.56 98.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 61.9 tp -123.49 114.16 19.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.314 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.0 m -131.52 125.3 20.57 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.025 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.31 156.76 54.55 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.639 2.226 . . . . 0.0 111.812 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.6 m -64.15 116.87 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.879 0.371 . . . . 0.0 110.89 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -136.6 155.59 49.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.73 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -95.27 167.4 11.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.99 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 62.6 m -67.18 128.58 36.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.253 . . . . 0.0 110.576 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -111.61 7.95 20.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.728 0.299 . . . . 0.0 111.345 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -128.71 149.96 50.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.688 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.7 -39.4 93.6 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.152 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.531 -1.149 . . . . 0.0 112.227 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 120.59 0.233 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 57.21 43.72 23.34 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.372 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -99.14 141.5 31.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.073 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.427 ' HA3' ' HE1' ' A' ' 46' ' ' TRP . . . 177.24 -176.47 48.07 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.322 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 52.7 m -124.61 147.17 48.66 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.0 mtp -87.26 71.61 10.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.71 153.89 33.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 150.43 144.1 3.86 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.407 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -152.5 113.88 4.27 Favored 'General case' 0 N--CA 1.462 0.157 0 O-C-N 122.868 -0.195 . . . . 0.0 110.747 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.0 t -156.99 151.0 24.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.394 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.32 162.06 54.47 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.52 -3.89 59.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 66.39 -121.4 0.3 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.679 0.392 . . . . 0.0 111.194 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.49 8.34 77.59 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.722 -0.751 . . . . 0.0 113.004 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -103.09 -164.23 1.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.621 0.248 . . . . 0.0 111.186 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.1 tp -61.85 135.81 57.73 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.224 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -71.09 106.83 3.87 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.235 0.541 . . . . 0.0 112.141 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.31 -9.8 37.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.712 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -99.86 21.5 12.49 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.178 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.403 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 21.5 m -78.68 113.38 16.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.387 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 20' ' ' THR . 26.8 mt -154.8 170.61 21.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.76 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.3 tp -63.24 -50.46 70.11 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -92.01 -35.99 13.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.09 0.471 . . . . 0.0 111.583 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.65 70.78 0.88 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.411 ' HB3' ' HD2' ' A' ' 26' ' ' PRO . 96.1 mt -45.09 158.84 0.28 Allowed Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.923 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' A' ' 25' ' ' LEU . 2.4 Cg_endo -39.96 165.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 124.67 3.58 . . . . 0.0 114.546 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.404 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 88.3 Cg_exo -48.88 -8.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.038 3.159 . . . . 0.0 114.919 -178.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.49 -36.82 67.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 117.867 0.303 . . . . 0.0 110.273 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.447 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 6.1 tp -107.8 -78.27 0.59 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tt -60.32 -48.54 81.29 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 27' ' ' PRO . . . -61.96 -51.09 59.47 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.331 -0.938 . . . . 0.0 114.436 -178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.05 -43.3 68.1 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.3 mt -67.36 -37.95 84.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -75.0 -31.97 61.54 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.652 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.51 -58.46 2.66 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.32 -44.8 99.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.512 HD23 ' NE2' ' A' ' 100' ' ' HIS . 76.1 mt -71.91 -19.55 61.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.528 -178.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.534 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 28.2 t0 -61.7 -38.28 87.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.123 0.487 . . . . 0.0 110.591 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.3 p -87.35 1.68 52.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.012 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.9 t -66.89 142.55 57.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.267 0.556 . . . . 0.0 111.634 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -131.51 50.07 2.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.468 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.8 -12.78 68.78 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.821 -0.627 . . . . 0.0 113.65 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.44 98.68 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.159 0.504 . . . . 0.0 111.097 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.1 mt -116.16 -29.41 6.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.51 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.81 107.9 0.55 Allowed Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.241 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.54 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 33.1 p90 -53.81 -44.99 70.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.988 0.394 . . . . 0.0 110.671 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.54 ' HG3' ' CD1' ' A' ' 46' ' ' TRP . 0.0 OUTLIER -85.31 -0.51 54.98 Favored 'General case' 0 C--O 1.219 -0.541 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 178.277 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.98 -47.36 91.1 Favored Glycine 0 C--N 1.329 0.166 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.076 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.8 mt -72.55 -42.13 65.0 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.858 179.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.31 -42.54 99.03 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.12 -42.04 99.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.092 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.94 -42.01 77.28 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.98 179.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.7 mt -65.62 -40.34 92.47 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.135 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 t 66.17 114.18 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.903 0.752 . . . . 0.0 112.533 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.459 ' OG ' ' HB2' ' A' ' 59' ' ' ASP . 96.0 p -91.42 -3.58 56.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.194 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 56.5 m 59.05 38.01 24.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.342 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -159.52 -177.9 6.74 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.773 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 87.6 mt -78.08 62.92 2.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.116 0.484 . . . . 0.0 110.607 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.459 ' HB2' ' OG ' ' A' ' 55' ' ' SER . 31.8 t0 -63.07 -38.15 90.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.733 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 29.6 m -59.72 -25.56 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.79 -44.52 95.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.153 0.502 . . . . 0.0 109.777 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -80.16 -23.85 40.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.283 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.563 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 80.3 mt -57.96 -44.57 87.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-O 120.616 0.246 . . . . 0.0 111.019 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -67.36 -37.34 83.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.132 0.491 . . . . 0.0 110.838 178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.42 -50.27 68.23 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.57 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 52.5 mm-40 -89.75 -5.34 57.07 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.5 p -57.93 -32.79 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-N 118.266 0.485 . . . . 0.0 111.065 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.8 -4.93 58.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.866 0.365 . . . . 0.0 110.516 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -104.78 21.41 16.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.781 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.578 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.8 11.18 33.28 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-O 118.407 -1.218 . . . . 0.0 114.976 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.5 OUTLIER 112.17 141.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.047 1.339 . . . . 0.0 111.624 177.34 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.596 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.8 t -128.54 -35.7 1.92 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.797 178.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.598 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -49.43 -62.11 5.01 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.847 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.495 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -89.55 -43.06 11.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.439 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 75.8 ttt180 -61.77 -47.63 84.29 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.596 ' HB3' ' O ' ' A' ' 72' ' ' SER . 50.3 tp10 -61.88 -43.67 98.38 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.3 -0.16 . . . . 0.0 111.308 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.78 -44.12 94.32 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.62 -39.67 94.13 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.928 0.394 . . . . 0.0 111.057 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -82.13 -6.36 59.13 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.7 m -59.77 -39.48 85.01 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -85.79 -90.67 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.39 -86.33 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.346 0.593 . . . . 0.0 110.018 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -113.25 -57.07 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.447 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 14.9 ttpp -132.12 -42.59 0.98 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.6 t30 49.1 33.62 5.01 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.652 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.65 167.8 21.28 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.5 p -127.23 158.86 36.03 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.67 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.19 -41.95 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.373 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -40.21 98.6 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.72 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.24 -45.62 87.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.771 0.32 . . . . 0.0 111.762 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 0.2 OUTLIER -76.1 -24.69 55.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.63 -179.653 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.15 -41.36 88.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.349 -179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.39 -41.59 98.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.138 0.495 . . . . 0.0 110.427 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.5 t -70.42 -39.86 76.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.416 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 90.6 mt -61.13 -40.26 93.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.608 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.93 -40.34 96.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.942 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.16 -48.03 81.88 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.38 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -71.11 -37.64 72.36 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.8 40.07 2.99 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.206 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.512 ' NE2' HD23 ' A' ' 37' ' ' LEU . 37.4 m80 -78.32 83.41 4.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -63.31 -41.46 98.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.144 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.3 tpp180 -63.53 -40.92 98.29 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 110.755 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.543 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.11 -39.23 89.2 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.484 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.588 ' O ' HG22 ' A' ' 107' ' ' ILE . 43.1 mm -62.58 -43.63 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.402 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -61.1 -48.2 82.76 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.788 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 mp -80.39 -21.26 42.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.588 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -62.53 -21.23 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-O 120.871 0.367 . . . . 0.0 111.082 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.1 m -62.78 -14.46 45.38 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.772 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.65 -26.26 64.31 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.551 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -71.95 127.54 32.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.276 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.21 62.3 0.28 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.658 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -146.88 152.08 38.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.619 0.247 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 45.1 t -95.01 94.95 4.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.192 0.52 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 90.8 mt -131.92 157.12 44.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.8 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.9 m -128.91 68.42 79.41 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.857 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.77 154.62 73.88 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.096 2.531 . . . . 0.0 112.1 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.5 m -61.92 142.91 57.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.491 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -124.14 135.33 53.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.679 0.276 . . . . 0.0 111.166 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.1 131.58 50.8 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.267 179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 54.2 m -136.95 139.94 41.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.683 -0.235 . . . . 0.0 110.615 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.7 -52.69 1.57 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.881 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . 0.411 ' HB3' ' H ' ' A' ' 123' ' ' GLU . 12.1 mp0 56.85 -152.61 0.39 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.26 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.411 ' H ' ' HB3' ' A' ' 122' ' ' GLN . 97.5 mt-10 -64.06 -38.9 92.75 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.931 0.396 . . . . 0.0 111.163 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.155 0 CA-C-O 118.36 -1.245 . . . . 0.0 112.141 179.934 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.991 0.424 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -149.8 160.07 43.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.661 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -126.16 147.03 49.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.51 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.79 179.52 47.73 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.3 m -128.74 150.28 50.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.651 0.262 . . . . 0.0 110.639 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.9 mtt -115.59 140.63 48.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.508 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.48 -139.91 0.77 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.648 0.593 . . . . 0.0 111.321 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.11 1.73 90.55 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.78 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -155.43 165.86 35.32 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.9 p -77.99 159.32 28.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.883 0.373 . . . . 0.0 110.988 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -93.02 -167.9 39.04 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.623 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -39.47 92.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.458 0.17 . . . . 0.0 111.458 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 58.72 40.19 23.48 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.531 0.519 . . . . 0.0 111.549 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -149.4 -133.06 2.15 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.18 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.92 90.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.685 0.279 . . . . 0.0 111.622 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.51 138.82 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.017 0.437 . . . . 0.0 111.071 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 p -101.63 111.32 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.854 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.21 -8.72 52.99 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.036 0.446 . . . . 0.0 111.449 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -104.31 21.68 16.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.139 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.6 m -69.13 119.73 13.87 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.62 176.52 7.19 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.454 178.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.94 -58.03 3.36 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -72.66 -35.69 67.77 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.536 0.684 . . . . 0.0 110.813 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -112.25 70.56 0.72 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.849 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.406 ' CG ' ' HZ1' ' A' ' 84' ' ' LYS . 98.5 mt -48.09 158.03 0.6 Allowed Pre-proline 0 CA--C 1.538 0.486 0 O-C-N 123.802 0.689 . . . . 0.0 111.589 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -38.77 165.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 124.987 3.792 . . . . 0.0 114.622 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.425 ' HA ' ' HA3' ' A' ' 31' ' ' GLY . 70.4 Cg_exo -50.29 -9.34 0.17 Allowed 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 123.874 3.049 . . . . 0.0 114.812 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.19 -36.15 68.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.575 0.171 . . . . 0.0 110.546 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.436 ' CD2' ' HD2' ' A' ' 84' ' ' LYS . 4.4 tp -108.25 -78.93 0.58 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.17 -0.612 . . . . 0.0 112.562 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.34 -48.6 80.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.427 ' O ' ' HB1' ' A' ' 35' ' ' ALA . . . -59.8 -52.35 53.5 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.525 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -72.37 -43.4 64.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.0 mt -67.5 -38.55 84.49 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -77.09 -33.0 57.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.101 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' A' ' 31' ' ' GLY . . . -85.57 -56.8 3.33 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.1 t -64.25 -45.07 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -177.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 53.0 mt -73.45 -17.62 61.22 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.152 -178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.49 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.6 t70 -59.41 -37.09 77.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 0.0 110.671 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.6 p -84.85 4.58 32.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.499 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 53.9 t -61.91 141.33 58.06 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.329 0.585 . . . . 0.0 112.005 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -132.36 45.94 2.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.89 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.86 -12.01 70.03 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.282 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.67 98.67 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.451 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.14 -23.49 8.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.018 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.499 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 79.73 109.86 0.25 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.957 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.429 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 8.2 p90 -53.06 -47.89 68.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.168 0.484 . . . . 0.0 110.532 178.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -83.34 2.3 36.94 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.02 -37.41 71.07 Favored Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.03 -177.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.19 -45.22 15.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.65 0.262 . . . . 0.0 110.832 179.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.597 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -61.84 -38.07 86.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.717 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.78 -43.4 94.39 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.157 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -39.23 93.8 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.187 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 tt -65.83 -37.85 87.34 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m 64.3 68.28 0.56 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.327 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.6 m -66.4 154.64 39.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.8 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 m -67.61 151.99 46.38 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.861 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 97.4 m95 68.07 -161.59 0.21 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.648 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -99.19 72.07 1.84 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.07 0.462 . . . . 0.0 111.041 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -70.59 -19.26 62.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.307 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.417 ' HA ' ' CD1' ' A' ' 63' ' ' ILE . 15.8 m -61.22 -30.66 48.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.5 -40.99 98.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.041 0.448 . . . . 0.0 110.211 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -74.39 -25.99 59.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.661 179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.494 ' O ' ' HB3' ' A' ' 72' ' ' SER . 83.1 mt -59.81 -43.71 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 109.975 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.573 ' O ' HG11 ' A' ' 67' ' ' VAL . 98.8 mt-10 -67.85 -36.15 79.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.135 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.81 -49.07 76.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.99 -4.04 57.66 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.573 HG11 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -56.67 -33.9 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 118.239 0.472 . . . . 0.0 111.12 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.54 -4.24 57.98 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.847 0.356 . . . . 0.0 110.733 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -106.15 21.99 16.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.015 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.56 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.29 21.74 9.18 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.269 -0.967 . . . . 0.0 114.281 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 94.37 141.83 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.36 1.064 . . . . 0.0 112.175 177.342 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.545 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.3 t -132.31 -29.9 1.56 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.078 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.597 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.58 -54.15 40.15 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 119.865 -1.159 . . . . 0.0 112.269 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.494 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -91.5 -43.4 9.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.149 0.499 . . . . 0.0 111.872 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.441 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.4 ttt180 -60.13 -47.58 85.33 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.548 -177.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.545 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.7 tt0 -62.59 -41.13 98.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.754 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 tp -61.19 -46.59 89.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.686 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.5 mt -71.61 -38.95 70.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.148 0.499 . . . . 0.0 111.014 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -75.32 -6.26 48.97 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -58.24 -40.35 81.5 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -86.77 -89.96 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.792 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -112.36 -55.79 2.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.436 ' HD2' ' CD2' ' A' ' 29' ' ' LEU . 20.3 ttpp -132.74 -44.58 0.89 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.604 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.3 t30 47.66 35.87 4.94 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.941 178.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 167.9 21.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.8 p -117.51 157.58 26.04 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.396 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.42 -39.44 79.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.431 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.47 99.27 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 120.902 -0.665 . . . . 0.0 112.981 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.04 -40.84 97.21 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 95' ' ' LEU . 0.2 OUTLIER -81.79 -24.34 36.0 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.128 -179.715 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.66 -41.94 91.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.14 -41.33 98.15 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.445 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -66.73 -41.85 88.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.216 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 93.2 mt -61.62 -40.88 96.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.844 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -65.03 -39.59 93.57 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.527 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -61.81 -48.83 78.84 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.44 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 15.3 tpt -72.53 -39.82 67.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.8 40.35 2.02 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.987 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.462 ' O ' HG12 ' A' ' 104' ' ' ILE . 77.4 m80 -78.38 87.68 4.4 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.718 0.294 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.64 -42.85 99.83 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.4 tpp180 -63.45 -41.08 98.64 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.125 0.488 . . . . 0.0 110.913 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.09 -38.12 85.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.646 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 107' ' ' ILE . 40.3 mm -61.29 -44.19 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.674 179.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -64.7 -41.21 96.17 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.621 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.35 -23.04 43.65 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.607 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.2 tp -63.87 -21.14 28.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.92 0.391 . . . . 0.0 111.425 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -75.48 -9.46 58.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.75 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -89.21 5.05 46.54 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -60.4 -49.17 78.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.63 0.252 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 156.02 179.11 30.83 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.537 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.05 2.98 52.02 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.364 . . . . 0.0 111.336 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 115' ' ' SER . 25.1 m -126.16 157.48 36.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.192 -179.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.61 -40.11 94.91 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.26 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.431 ' O ' HG21 ' A' ' 113' ' ' VAL . 69.7 m -132.67 148.21 68.64 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.794 -0.184 . . . . 0.0 111.107 -179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -78.05 68.22 7.88 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.742 2.295 . . . . 0.0 112.788 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 63.5 m -106.33 137.61 43.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.628 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -127.37 148.52 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.592 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -74.2 143.74 45.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.797 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.6 m -122.95 146.06 47.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -106.11 71.89 0.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.64 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 58.9 -93.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.466 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -90.43 -9.85 45.98 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.706 0.288 . . . . 0.0 111.369 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.569 -179.87 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.598 0.237 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 57.75 53.37 7.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.035 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -63.97 -39.43 94.12 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.726 0.298 . . . . 0.0 111.28 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.99 -55.64 3.68 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.497 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.2 m 59.92 41.44 17.73 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.848 0.459 . . . . 0.0 111.875 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.5 mmt -120.53 135.1 55.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.582 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.72 155.25 39.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.911 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -172.57 175.96 45.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.058 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 57.0 t30 55.15 44.23 28.16 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.103 0.478 . . . . 0.0 111.253 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -118.87 147.66 43.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.68 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 91.6 -8.29 78.86 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.753 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.64 45.83 0.97 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.726 0.298 . . . . 0.0 111.15 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.9 ttp-105 -61.7 -46.38 89.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.825 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.07 153.3 27.25 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 121.016 -0.612 . . . . 0.0 113.457 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.43 94.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.155 0.503 . . . . 0.0 110.857 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.89 149.33 21.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.624 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.511 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 0.8 OUTLIER -72.29 107.55 4.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.268 0.556 . . . . 0.0 111.605 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.67 -8.56 43.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.125 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.503 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 79.7 m80 -103.33 21.05 16.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.69 -178.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 77.7 m -77.74 120.07 22.13 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.59 170.51 21.33 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.029 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.6 -50.4 69.56 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -91.53 -35.0 14.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.363 0.602 . . . . 0.0 111.319 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.434 ' HA ' ' HZ2' ' A' ' 84' ' ' LYS . 1.2 p-10 -103.57 71.58 1.09 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.879 178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.9 mt -44.7 156.95 0.33 Allowed Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.935 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -39.33 164.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 124.999 3.799 . . . . 0.0 114.488 -178.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.511 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 9.6 Cg_endo -54.65 -7.72 0.98 Allowed 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.643 2.895 . . . . 0.0 113.973 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -55.43 -35.53 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.542 ' HB3' ' CE ' ' A' ' 84' ' ' LYS . 2.9 tp -105.7 -78.07 0.58 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.044 178.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.412 ' HB2' ' HZ3' ' A' ' 84' ' ' LYS . 61.7 tp -63.08 -46.04 89.31 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 35' ' ' ALA . . . -60.01 -54.32 38.39 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.633 -0.794 . . . . 0.0 114.797 -177.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.407 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.7 tm-20 -73.2 -42.81 62.25 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 95.9 mt -67.6 -37.89 83.2 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.605 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 13.7 p -78.98 -32.48 45.27 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.883 -179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.477 ' HB2' ' O ' ' A' ' 31' ' ' GLY . . . -85.31 -55.62 3.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.93 -44.58 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 80.9 mt -72.62 -19.27 61.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.249 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.605 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.2 t0 -60.49 -36.81 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.88 0.371 . . . . 0.0 110.829 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.1 m -86.01 5.14 34.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.108 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.506 ' HG ' ' N ' ' A' ' 45' ' ' GLY . 52.0 t -65.33 141.94 58.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.291 0.567 . . . . 0.0 111.629 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -130.0 43.72 3.08 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.891 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.06 -12.5 69.07 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.402 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.3 97.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.037 0.418 . . . . 0.0 111.4 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.75 -23.38 10.65 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.649 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.506 ' N ' ' HG ' ' A' ' 40' ' ' CYS . . . 78.41 109.9 0.19 Allowed Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.738 -178.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -52.73 -48.61 66.58 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 117.315 0.558 . . . . 0.0 110.674 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -83.74 1.28 43.49 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.576 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.67 -43.18 94.5 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.086 -178.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.2 mt -80.41 -41.58 24.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.029 0.415 . . . . 0.0 111.088 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.64 -41.68 98.21 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -60.18 -46.2 90.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.303 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -67.51 -39.19 85.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.943 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 tt -65.76 -43.52 88.65 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.853 -178.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.0 t -153.96 142.56 20.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 0.0 111.2 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.0 m -121.09 137.54 54.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.329 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.9 t -156.52 154.34 30.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.049 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.0 m-90 -71.54 136.79 47.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.629 0.252 . . . . 0.0 110.657 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.2 mt 64.12 14.91 8.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.066 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -65.08 -39.63 93.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.221 0.534 . . . . 0.0 111.061 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.5 m -68.11 -17.51 22.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.493 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.04 -47.84 84.52 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-O 120.608 0.242 . . . . 0.0 110.879 -178.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.561 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 8.3 p-80 -78.5 -20.08 51.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.446 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.546 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -62.23 -42.22 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.461 0.648 . . . . 0.0 110.068 178.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.609 ' O ' HG13 ' A' ' 67' ' ' VAL . 80.0 mm-40 -69.54 -33.4 72.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.756 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.3 mttt -62.86 -48.3 79.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.566 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 57.3 mm-40 -89.81 -4.33 57.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.668 -0.645 . . . . 0.0 112.739 -178.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.609 HG13 ' O ' ' A' ' 64' ' ' GLU . 4.3 p -57.38 -33.3 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.161 0.437 . . . . 0.0 111.173 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.27 -4.63 58.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.939 0.4 . . . . 0.0 110.571 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -107.13 22.45 15.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.059 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.612 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.65 13.4 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.257 -0.973 . . . . 0.0 114.595 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 102.21 144.67 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.858 1.263 . . . . 0.0 111.916 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.605 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.9 t -130.7 -31.61 1.75 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.195 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.501 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.21 -63.35 5.25 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.841 -1.171 . . . . 0.0 111.546 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.446 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -89.08 -39.91 13.31 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.441 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 59.1 ttt85 -62.37 -48.7 78.59 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.605 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.1 tp10 -63.43 -39.71 95.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.5 tp -61.05 -45.98 92.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.28 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 83.9 mt -69.51 -39.32 77.64 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.945 0.402 . . . . 0.0 110.979 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -77.01 -5.78 50.06 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.8 m -58.53 -40.15 82.15 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -86.42 -89.66 0.11 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.735 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.7 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -114.37 -55.01 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.542 ' CE ' ' HB3' ' A' ' 29' ' ' LEU . 1.2 ttmp? -132.05 -44.66 0.95 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 175.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 46.03 36.88 3.3 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.918 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 161.91 36.1 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.0 p -115.33 155.2 27.77 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.498 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.4 mp -60.56 -38.52 78.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.12 -179.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.47 -39.83 97.84 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.581 179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.32 -45.3 91.95 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.636 0.255 . . . . 0.0 111.644 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.501 ' O ' HD12 ' A' ' 95' ' ' LEU . 0.4 OUTLIER -72.51 -26.0 61.61 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.832 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 53.6 mt -59.54 -38.22 80.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -61.79 -42.17 98.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.037 0.446 . . . . 0.0 109.998 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 91.1 t -70.72 -41.22 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.352 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 91' ' ' LEU . 4.5 mp -59.01 -38.7 79.84 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.612 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.51 -40.24 96.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.867 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.53 -41.99 92.47 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.4 tpt -70.99 -38.73 72.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.419 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.0 30.19 35.7 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.177 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -79.36 107.43 12.11 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.044 0.449 . . . . 0.0 110.649 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.95 -41.45 95.48 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -61.33 -40.52 94.53 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.234 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.421 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.99 -39.74 90.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.5 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.59 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -63.12 -43.89 99.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.014 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -64.48 -41.42 96.5 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.407 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 0.5 OUTLIER -80.87 -22.04 40.18 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.59 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.8 tp -62.04 -20.36 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 70.3 p -72.07 -11.26 60.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.639 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -83.49 15.98 2.82 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.887 0.375 . . . . 0.0 111.471 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' TYR . . . . . 0.482 ' CD1' HD12 ' A' ' 88' ' ' ILE . 63.4 t80 -94.92 124.72 39.13 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 110.814 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -142.39 72.59 0.38 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.403 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -147.6 155.93 42.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.683 0.277 . . . . 0.0 110.98 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.6 p -135.68 145.12 31.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.455 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.6 mt 62.75 38.9 11.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.57 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 78.1 p -77.25 155.84 81.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.208 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.0 144.58 99.46 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.021 2.48 . . . . 0.0 112.814 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.9 m -119.6 149.62 41.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.54 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.8 pm0 -67.2 151.57 47.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.341 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -82.05 -11.97 58.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.395 -179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 51.0 m 57.48 41.18 26.44 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.585 0.553 . . . . 0.0 111.372 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -111.67 126.25 54.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.256 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 65.95 -99.75 0.06 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.631 0.582 . . . . 0.0 111.422 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -119.12 139.7 51.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 110.689 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.45 -179.923 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 C--O 1.22 -0.495 0 N-CA-C 111.228 0.084 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.491 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.3 m -75.02 113.5 12.42 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 20' ' ' THR . 20.5 mt -159.81 162.14 34.7 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.64 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.2 tp -63.87 -50.04 70.39 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -81.62 -35.77 29.69 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.291 0.567 . . . . 0.0 111.792 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -112.56 71.01 0.73 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.679 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -44.68 156.92 0.33 Allowed Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 124.009 0.818 . . . . 0.0 111.955 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -39.03 165.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 125.09 3.86 . . . . 0.0 114.849 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -50.06 -8.95 0.14 Allowed 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 124.061 3.174 . . . . 0.0 114.906 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.548 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.92 -36.04 67.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.68 0.218 . . . . 0.0 110.673 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.7 tp -107.82 -78.65 0.58 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.529 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -61.87 -49.1 77.61 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.27 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.59 -51.6 58.11 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 120.405 -0.902 . . . . 0.0 114.535 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.444 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.4 tm-20 -72.67 -43.77 62.68 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.35 -38.94 88.77 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.9 p -75.21 -31.95 61.05 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.032 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.27 -55.95 3.77 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.4 t -64.47 -45.21 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.03 -18.59 61.94 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.06 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 16.9 t70 -59.96 -38.07 81.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.987 0.422 . . . . 0.0 110.772 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -83.3 3.02 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.444 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 48.3 t -62.37 141.53 58.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.402 0.62 . . . . 0.0 112.186 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -133.33 46.37 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.642 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.56 -12.86 68.25 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.462 -0.79 . . . . 0.0 113.177 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.71 98.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.964 0.382 . . . . 0.0 111.549 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -115.29 -25.2 8.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.174 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 80.14 107.58 0.27 Allowed Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.002 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -53.32 -46.0 69.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 117.244 0.522 . . . . 0.0 111.078 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.4 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.5 ptt180 -82.97 1.69 38.54 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.872 178.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.32 -44.13 93.53 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.323 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -73.55 -43.77 59.1 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.182 0.491 . . . . 0.0 111.211 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.78 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.67 -39.51 93.81 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.62 -42.62 97.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.795 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.473 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 121.089 0.471 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.47 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -76.13 -21.54 56.49 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.507 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.52 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.4 mt -59.47 -42.22 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.093 0.473 . . . . 0.0 110.632 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.456 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -66.51 -35.17 79.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.97 0.414 . . . . 0.0 110.946 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.8 mttt -63.02 -49.57 74.12 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -177.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 7.5 mt-10 -89.74 -2.95 58.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.5 p -54.51 -32.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 118.423 0.556 . . . . 0.0 111.432 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.12 -4.73 58.21 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.793 0.33 . . . . 0.0 111.007 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -106.48 22.47 15.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.105 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.629 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.92 19.22 12.15 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.101 -1.047 . . . . 0.0 114.131 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 96.5 142.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.337 1.055 . . . . 0.0 111.862 177.594 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.5 t -131.0 -26.42 2.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.388 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.58 -64.58 4.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.095 -1.05 . . . . 0.0 111.892 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.7 m -88.32 -38.48 15.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 111.694 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.3 ttt-85 -60.37 -47.75 84.71 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -177.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.563 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.5 tt0 -63.21 -40.35 97.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.758 0.313 . . . . 0.0 110.866 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.78 HD22 ' HA ' ' A' ' 50' ' ' ALA . 59.0 tp -61.1 -46.45 90.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.65 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.495 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.2 mt -70.5 -38.58 74.34 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -75.7 -6.73 51.94 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.685 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.8 m -58.65 -40.13 82.57 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -86.26 -89.57 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.788 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.59 -86.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -114.13 -54.83 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.9 ttpp -132.66 -44.2 0.9 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.437 175.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.7 t30 47.76 35.78 5.04 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.753 0.821 . . . . 0.0 111.815 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.25 171.08 14.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.921 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -121.21 157.96 29.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.73 -39.09 78.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.69 -39.72 98.28 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.774 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.35 -45.52 90.82 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.606 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.54 -23.98 45.91 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.393 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.6 tp -59.36 -40.64 87.1 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.673 0.273 . . . . 0.0 110.724 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -62.24 -41.53 98.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.299 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -69.56 -41.11 80.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.0 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.2 mp -59.84 -41.12 90.68 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.826 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.61 -40.51 97.09 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.073 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.78 -46.18 89.21 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.823 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.3 mmm -70.09 -37.34 75.38 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.775 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.48 38.51 5.28 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.383 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.476 ' NE2' ' HB3' ' A' ' 44' ' ' LEU . 39.4 m170 -79.98 91.71 5.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.928 0.394 . . . . 0.0 110.631 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -62.9 -42.08 99.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.9 tpt85 -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 110.647 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.24 -38.91 88.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.731 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 45.1 mm -62.78 -39.56 85.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.863 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -60.25 -48.0 83.61 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.222 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.444 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -80.71 -22.04 40.68 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -178.882 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 3.1 tp -60.66 -20.66 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 120.871 0.367 . . . . 0.0 111.424 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -71.94 -12.22 61.15 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.609 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.25 -27.18 65.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.189 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.8 t80 . . . . . 0 CA--C 1.532 0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.891 179.582 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.217 -0.615 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.6 m -71.24 116.07 11.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.654 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.41 162.44 17.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.312 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -64.84 -50.46 66.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.02 -35.81 23.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.412 0.625 . . . . 0.0 111.408 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -110.11 70.67 0.73 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.146 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.9 mt -46.35 156.18 0.51 Allowed Pre-proline 0 N--CA 1.467 0.405 0 O-C-N 124.067 0.854 . . . . 0.0 111.69 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -38.83 165.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 124.98 3.787 . . . . 0.0 114.698 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.91 -8.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.2 3.266 . . . . 0.0 115.204 -178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.593 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.3 -36.64 66.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.975 0.352 . . . . 0.0 110.39 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.909 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.5 tp -106.65 -78.33 0.58 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.41 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.5 OUTLIER -60.5 -51.7 68.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.57 -51.26 60.13 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.639 -0.791 . . . . 0.0 114.826 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.498 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.3 tm-20 -70.88 -43.62 68.0 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.444 HD13 HG21 ' A' ' 74' ' ' THR . 95.4 mt -67.08 -38.8 86.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.3 p -72.19 -31.07 65.57 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.62 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.62 -55.49 3.96 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.53 -45.69 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -73.11 -19.16 61.2 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.377 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.7 t70 -60.11 -39.16 85.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.012 0.434 . . . . 0.0 111.098 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.9 m -90.22 9.12 29.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.971 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 t -68.02 143.82 55.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.205 0.526 . . . . 0.0 111.695 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.32 49.51 2.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.217 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.69 -12.57 69.21 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.561 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.71 98.73 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.16 0.505 . . . . 0.0 111.136 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.4 mt -119.44 -26.63 5.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.722 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.92 113.51 0.32 Allowed Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.894 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 9.6 p90 -53.29 -47.44 69.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.009 0.404 . . . . 0.0 110.473 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.9 ptt180 -84.29 1.11 46.39 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.917 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.69 -46.7 91.9 Favored Glycine 0 CA--C 1.517 0.199 0 C-N-CA 120.159 -1.02 . . . . 0.0 113.334 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.18 -42.61 59.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.017 0.408 . . . . 0.0 110.911 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.6 -40.43 96.91 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.37 -45.81 92.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.237 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 . . . . . 0 N--CA 1.462 0.144 0 CA-C-O 120.842 0.353 . . . . 0.0 111.234 179.034 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.463 0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -74.69 -25.08 58.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.962 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.536 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.7 mt -59.88 -43.4 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 110.161 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.555 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -66.99 -36.01 81.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.69 -49.08 76.52 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -90.18 -3.78 57.66 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.6 p -56.05 -34.41 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.271 0.487 . . . . 0.0 111.321 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.2 -4.21 58.31 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 110.813 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -105.67 21.93 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.751 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.617 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.04 21.42 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.362 -0.923 . . . . 0.0 114.276 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 94.91 141.56 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.319 1.047 . . . . 0.0 112.159 177.376 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.536 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.8 t -131.56 -29.89 1.71 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.42 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -53.02 -66.98 2.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.356 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.444 HG21 HD13 ' A' ' 33' ' ' LEU . 24.9 m -87.38 -36.71 17.62 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 122.625 -0.338 . . . . 0.0 111.525 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -60.77 -47.16 87.58 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 81.7 tt0 -62.11 -42.4 99.19 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.17 -45.62 90.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.291 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.637 HD22 ' HG3' ' A' ' 84' ' ' LYS . 97.3 mt -67.6 -40.21 84.77 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.843 0.354 . . . . 0.0 111.285 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -81.5 -5.85 58.37 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.6 t -58.99 -41.35 87.44 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.9 m95 -85.4 -89.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.796 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.53 -87.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -114.47 -54.29 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.909 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.0 ttpp -132.3 -43.51 0.94 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.4 t30 48.25 34.19 4.31 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.791 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.479 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.51 170.83 15.2 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.789 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 63.2 p -126.45 159.13 34.21 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.375 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.568 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.7 mp -59.7 -40.03 81.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.407 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.425 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.0 -39.49 97.14 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.546 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -63.82 -44.23 93.85 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.665 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -73.85 -27.58 61.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.736 -179.532 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.6 mt -60.28 -32.83 71.56 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.542 0.21 . . . . 0.0 111.442 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -61.03 -42.52 98.63 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.479 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -86.3 -23.21 6.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.411 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.8 mp -61.9 -43.25 99.24 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.833 0.349 . . . . 0.0 110.255 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -65.72 -39.95 91.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.739 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -64.21 -43.84 93.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.03 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -71.75 -39.13 70.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.595 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.24 33.36 6.0 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.551 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -75.92 86.28 2.86 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.065 0.459 . . . . 0.0 111.35 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.84 -41.21 95.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.549 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.24 -39.86 94.82 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.487 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.549 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.71 -38.81 86.3 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.731 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.1 mt -61.47 -43.67 97.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.278 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -61.48 -47.66 84.67 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.245 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.498 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -77.88 -22.46 49.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -179.149 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.593 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.1 tp -63.32 -19.99 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.773 0.321 . . . . 0.0 111.478 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.2 p -67.84 -12.84 61.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.429 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -69.83 -27.45 64.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.52 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 . . . . . 0 C--O 1.233 0.193 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 179.316 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 . . . . . 0 C--O 1.222 -0.393 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t -74.43 125.37 28.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -178.44 4.99 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.492 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.05 -58.23 3.26 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -73.92 -35.73 64.64 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.554 0.692 . . . . 0.0 110.513 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -109.91 70.28 0.72 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.732 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.611 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.6 mt -48.34 156.38 0.81 Allowed Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.987 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -34.93 163.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 125.086 3.857 . . . . 0.0 115.17 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.24 -8.72 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 124.277 3.318 . . . . 0.0 115.054 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.62 -35.56 63.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.605 0.184 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HB3' ' A' ' 91' ' ' LEU . 6.6 tp -108.64 -79.19 0.58 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.3 tp -62.01 -47.75 83.37 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.63 -51.3 59.56 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.651 -0.785 . . . . 0.0 114.632 -177.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -70.5 -43.52 69.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.71 -38.44 86.74 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.967 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.8 p -73.25 -31.82 64.34 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.797 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.34 -54.49 4.56 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -178.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 71.5 t -64.54 -43.99 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.8 mt -71.09 -18.25 62.55 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.419 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 5.7 t70 -59.58 -37.81 79.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 0.0 110.661 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.1 m -86.75 7.39 26.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.9 t -65.54 140.01 58.52 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.345 0.593 . . . . 0.0 111.746 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -131.42 44.06 2.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.454 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.59 -10.91 72.21 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.392 -0.822 . . . . 0.0 113.017 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.19 97.71 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.905 0.352 . . . . 0.0 111.562 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -116.24 -22.19 8.98 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.53 113.72 0.25 Allowed Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.764 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -52.37 -49.2 64.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.284 0.542 . . . . 0.0 109.925 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.455 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.6 ptt180 -83.93 1.38 43.73 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.562 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.62 92.33 Favored Glycine 0 CA--C 1.516 0.129 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.437 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.409 HD22 HD12 ' A' ' 95' ' ' LEU . 89.3 mt -73.7 -43.32 59.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 0.0 111.223 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.517 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.53 -39.9 94.63 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -59.69 -45.05 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.383 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 . . . . . 0 N--CA 1.463 0.223 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.745 179.445 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -68.84 -26.36 65.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.023 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.654 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.9 mt -59.67 -38.99 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.183 0.516 . . . . 0.0 110.455 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.491 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.4 mm-40 -79.66 -21.24 45.01 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.106 -0.371 . . . . 0.0 111.193 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.17 -45.41 60.53 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.621 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.3 mt-10 -87.97 -4.72 58.78 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.8 p -58.56 -28.55 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.236 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -74.73 -14.75 60.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -95.66 9.06 41.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.917 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 71' ' ' LYS . . . 104.22 -7.2 47.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 118.33 -1.261 . . . . 0.0 114.866 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 2.0 tppt? 158.58 139.1 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.263 1.032 . . . . 0.0 112.088 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.654 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.0 t -134.27 -24.17 1.64 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.46 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.23 -67.43 2.22 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.97 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.3 m -88.62 -35.12 17.03 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.569 -0.371 . . . . 0.0 111.482 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.551 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 74.0 ttt180 -60.75 -46.35 90.78 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.731 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 72' ' ' SER . 80.7 tt0 -60.54 -44.27 96.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 110.52 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -62.54 -47.82 82.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.253 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.906 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.3 mt -65.16 -39.81 93.45 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.53 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -81.0 -5.75 57.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.8 m -59.34 -39.84 84.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 65.8 m95 -86.27 -89.97 0.11 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.278 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.82 -87.07 0.49 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.134 0.492 . . . . 0.0 110.053 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -112.62 -56.75 2.37 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.906 ' HG3' HD22 ' A' ' 78' ' ' LEU . 13.6 ttpp -131.95 -43.57 0.98 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.564 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.6 t30 49.73 28.93 2.89 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.975 -1.012 . . . . 0.0 112.91 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.611 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 37.8 mttp -135.51 134.17 39.22 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 44.5 p -83.82 161.19 21.01 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.61 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.06 -40.33 82.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.143 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.36 -40.21 98.66 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.49 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -63.46 -48.59 77.08 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.921 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -75.98 -24.11 55.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.862 -179.625 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.722 HD13 HD13 ' A' ' 107' ' ' ILE . 62.4 tp -58.82 -39.38 81.01 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.425 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.88 -41.16 95.43 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.868 0.366 . . . . 0.0 110.452 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.7 -40.71 84.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 121.224 0.535 . . . . 0.0 109.729 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -60.31 -39.92 88.72 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.613 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.39 -40.02 96.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.812 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -63.94 -41.67 97.55 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.731 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.0 tpt -70.05 -38.84 75.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.086 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.29 29.77 11.92 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.721 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -76.22 99.47 4.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.924 0.392 . . . . 0.0 111.06 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.58 -41.83 96.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.669 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -62.31 -41.39 98.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.125 0.488 . . . . 0.0 110.805 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.89 -39.88 90.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.701 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.561 ' O ' HG22 ' A' ' 107' ' ' ILE . 42.0 mm -62.66 -45.21 99.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -66.51 -40.76 89.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 106' ' ' LEU . 1.3 tp -83.89 -21.79 31.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.722 HD13 HD13 ' A' ' 92' ' ' LEU . 10.2 tt -65.79 -20.22 26.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.927 0.394 . . . . 0.0 111.321 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.0 p -70.05 -9.93 57.0 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.814 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.41 -17.62 63.02 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.611 ' HE1' HD22 ' A' ' 25' ' ' LEU . 89.7 t80 . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 120.779 0.323 . . . . 0.0 110.352 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.5 m80 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.9 t -81.64 113.58 19.75 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.7 mt -153.36 167.09 30.57 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.836 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.13 -50.19 71.42 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -81.8 -35.58 29.36 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.493 0.663 . . . . 0.0 111.348 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.42 71.85 0.76 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.009 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -44.53 155.45 0.37 Allowed Pre-proline 0 CA--C 1.538 0.515 0 O-C-N 123.978 0.798 . . . . 0.0 111.22 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -38.69 165.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 124.846 3.697 . . . . 0.0 114.794 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -49.05 -8.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 124.01 3.14 . . . . 0.0 114.99 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.778 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.76 -35.79 64.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.741 0.246 . . . . 0.0 110.657 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.38 -78.64 0.59 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.4 tp -61.39 -48.65 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -51.1 60.73 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.595 -0.812 . . . . 0.0 114.494 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -70.79 -43.0 69.59 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.9 -38.68 86.73 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.842 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.661 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -73.25 -30.52 63.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.656 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.81 -55.45 3.96 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.72 -45.64 96.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.883 HD11 HD12 ' A' ' 49' ' ' LEU . 88.7 mt -71.62 -21.01 61.9 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.12 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.8 t0 -61.55 -38.65 88.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.039 0.447 . . . . 0.0 110.503 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.4 p -85.2 1.54 47.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.107 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.6 t -64.22 141.33 58.81 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.297 0.57 . . . . 0.0 111.663 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.91 39.04 3.85 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.926 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.18 -16.73 57.89 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.06 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.06 99.34 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.971 0.415 . . . . 0.0 111.816 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.89 -21.56 12.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.183 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.435 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.11 107.05 0.12 Allowed Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.563 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.2 p90 -52.88 -50.81 63.12 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 117.313 0.557 . . . . 0.0 110.349 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.542 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.77 -0.04 52.37 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.095 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.42 95.57 Favored Glycine 0 C--O 1.23 -0.115 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.023 -177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 37' ' ' LEU . 94.0 mt -81.79 -42.4 19.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.735 0.303 . . . . 0.0 111.215 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.45 -41.73 96.37 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -61.48 -41.26 96.98 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.115 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 120.76 0.314 . . . . 0.0 111.203 179.176 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 CA--C 1.529 0.163 0 CA-C-O 120.637 0.256 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -72.66 -29.5 63.49 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.216 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.562 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.7 mt -60.23 -43.11 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.537 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.1 mm-40 -67.64 -35.93 79.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.238 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.2 -48.61 79.24 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -89.95 -3.47 58.01 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -55.85 -34.04 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 118.202 0.455 . . . . 0.0 111.432 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.22 -4.77 58.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.935 0.397 . . . . 0.0 110.853 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.48 21.81 16.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.818 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.13 21.22 9.65 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.311 -0.947 . . . . 0.0 114.22 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 94.18 141.77 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.281 1.032 . . . . 0.0 112.248 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.565 ' H ' ' HD3' ' A' ' 71' ' ' LYS . 4.1 t -129.99 -30.38 2.01 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.998 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.35 -66.07 3.05 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.022 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.456 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.02 -35.6 18.69 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.822 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.494 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.7 ttt180 -62.69 -47.22 84.6 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.552 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -62.34 -41.33 98.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.615 0.245 . . . . 0.0 111.152 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.482 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.9 tp -61.07 -47.22 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.979 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.46 HD22 ' HG3' ' A' ' 84' ' ' LYS . 84.2 mt -71.46 -39.4 70.98 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.069 0.462 . . . . 0.0 111.673 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -76.62 -7.26 54.9 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -58.43 -38.59 77.75 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -87.58 -90.57 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.676 -0.409 . . . . 0.0 110.928 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.44 -86.81 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -110.96 -56.89 2.31 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.62 -43.49 0.91 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.419 176.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.4 36.21 6.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.718 0.807 . . . . 0.0 111.788 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.99 171.05 14.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.485 -179.264 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -121.21 157.4 30.34 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.324 179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.449 HG13 HD13 ' A' ' 29' ' ' LEU . 1.2 mp -60.5 -39.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.374 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.97 -39.45 98.08 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.862 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -63.23 -45.67 90.53 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.604 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.49 -24.6 50.1 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.658 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.509 HD13 HD13 ' A' ' 107' ' ' ILE . 61.8 tp -58.97 -41.74 88.24 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.176 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.94 -41.81 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.087 0.47 . . . . 0.0 110.471 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.0 t -68.3 -42.06 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.431 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.0 mp -60.28 -40.17 89.47 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.004 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.1 -39.21 93.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.495 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -62.61 -45.33 93.34 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.476 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 14.5 tpt -72.61 -39.41 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.257 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.37 39.55 3.44 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.472 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.407 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 13.3 t-160 -80.47 95.23 6.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.177 0.513 . . . . 0.0 110.546 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.89 -42.3 94.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -62.77 -39.38 94.0 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.855 0.36 . . . . 0.0 111.695 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.407 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -60.54 -38.7 85.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.279 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -60.93 -43.27 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.035 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -62.96 -42.08 99.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.03 -31.13 25.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.778 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.0 tt -62.3 -24.49 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.18 0.514 . . . . 0.0 110.47 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 85.1 m -64.88 -26.13 68.19 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.076 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -67.92 -20.44 65.09 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.574 ' HE1' HD22 ' A' ' 25' ' ' LEU . 81.0 t80 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.22 -0.452 0 N-CA-C 111.264 0.098 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -72.61 115.08 11.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.794 0.33 . . . . 0.0 111.886 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 24' ' ' ASP . 23.8 tp -152.85 163.24 40.12 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.94 -47.63 85.54 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -90.87 -35.83 14.54 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.425 0.631 . . . . 0.0 110.555 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 83' ' ' GLN . 49.2 t0 -94.03 74.91 4.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.737 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.431 HD13 ' CE1' ' A' ' 110' ' ' TYR . 82.5 mt -47.37 154.21 0.86 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.357 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -38.61 166.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 124.82 3.68 . . . . 0.0 114.894 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.78 -9.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 124.312 3.341 . . . . 0.0 115.545 -178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.04 -34.82 63.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.087 0.403 . . . . 0.0 109.987 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.876 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.6 tp -107.79 -77.88 0.59 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -61.7 -52.03 65.95 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -178.138 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.44 -50.57 66.32 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.343 -0.932 . . . . 0.0 114.82 -177.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.84 -43.74 74.87 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 95' ' ' LEU . 97.1 mt -68.23 -39.19 82.4 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 120.69 -0.404 . . . . 0.0 112.054 -179.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.0 p -71.6 -27.99 63.5 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.357 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.72 -57.54 3.01 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.36 -45.26 96.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.63 HD11 HD12 ' A' ' 49' ' ' LEU . 97.6 mt -70.69 -22.49 62.46 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.68 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.6 t0 -61.11 -36.5 79.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.981 0.42 . . . . 0.0 110.872 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.3 m -88.06 11.45 16.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.119 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 46.2 t -62.16 143.24 57.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.564 0.697 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -131.9 36.97 3.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.393 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.64 -13.96 66.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.925 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.84 96.29 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.56 -25.5 9.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.11 0.481 . . . . 0.0 110.561 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.457 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 77.22 109.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.184 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.1 p90 -52.7 -49.85 64.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.377 0.588 . . . . 0.0 110.625 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.437 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.5 ptt180 -83.91 -0.38 51.15 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.485 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.43 -45.96 93.7 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.704 -177.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.63 HD12 HD11 ' A' ' 37' ' ' LEU . 90.6 mt -74.86 -44.14 50.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.213 0.53 . . . . 0.0 111.17 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -39.91 94.5 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.0 tp10 -59.23 -44.45 92.31 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.522 0.514 . . . . 0.0 111.371 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 mtt85 . . . . . 0 C--N 1.333 -0.136 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.708 179.247 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.922 0.391 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.452 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -77.17 -22.33 52.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.174 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.599 ' O ' HG13 ' A' ' 67' ' ' VAL . 78.9 mt -60.2 -42.62 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.9 0.381 . . . . 0.0 110.835 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 67' ' ' VAL . 80.3 mm-40 -71.48 -20.99 62.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.531 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -72.11 -46.66 55.8 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 67.3 mm-40 -89.78 -2.98 58.37 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -177.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 63' ' ' ILE . 16.2 m -55.43 -32.22 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.95 0.795 . . . . 0.0 111.942 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -88.44 -5.63 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.471 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -107.97 18.21 21.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.51 23.5 7.92 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.113 -1.042 . . . . 0.0 114.934 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 95.3 143.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.249 1.02 . . . . 0.0 112.559 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.612 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.1 t -132.64 -32.13 1.31 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.301 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.31 -67.39 1.99 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.697 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.2 m -86.89 -36.35 18.46 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.652 0.263 . . . . 0.0 111.283 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.98 -47.98 83.94 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.4 tt0 -61.42 -43.18 99.32 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.575 0.226 . . . . 0.0 111.26 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.31 -45.46 93.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.115 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.527 HD22 ' HG3' ' A' ' 84' ' ' LYS . 94.5 mt -69.4 -38.72 78.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.853 0.359 . . . . 0.0 111.356 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 22.5 m95 -77.31 -5.87 51.12 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.7 m -59.1 -39.67 82.95 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -86.12 -89.95 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.987 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.39 -87.52 0.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.569 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 97.7 mm-40 -111.8 -53.95 2.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.876 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.5 ttpp -133.14 -43.88 0.86 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.938 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.8 t30 48.59 37.99 10.35 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.137 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 171.96 13.52 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.9 p -120.69 156.14 32.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.428 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -60.54 -38.62 78.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.106 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.58 -39.76 98.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.751 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.3 -45.73 90.03 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.623 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.18 -24.72 51.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.382 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.469 ' HA ' HD12 ' A' ' 95' ' ' LEU . 60.7 tp -59.83 -41.65 91.79 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.851 0.358 . . . . 0.0 110.85 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -62.55 -40.42 96.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.093 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.541 HG12 HD22 ' A' ' 49' ' ' LEU . 85.8 t -68.1 -40.07 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.11 178.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 33' ' ' LEU . 91.5 mt -61.09 -39.22 89.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.451 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -62.77 -39.33 93.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.568 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -62.37 -39.87 94.6 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.698 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -12.12 41.03 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.75 39.88 59.26 Favored Glycine 0 C--N 1.329 0.157 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.725 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -70.75 93.43 0.95 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.113 0.483 . . . . 0.0 110.608 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.64 ' O ' HG22 ' A' ' 104' ' ' ILE . 82.9 mtt85 -64.5 -42.25 95.94 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -66.59 -39.43 88.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.78 -39.07 87.49 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 101' ' ' ARG . 8.5 tp -62.83 -31.87 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.44 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -70.57 -41.2 72.72 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.71 0.29 . . . . 0.0 111.228 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.29 -22.19 30.79 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.558 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.8 tp -62.03 -20.49 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 120.93 0.395 . . . . 0.0 111.231 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.4 p -70.39 -12.54 61.65 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.663 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.87 -26.8 64.36 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.76 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.431 ' CE1' HD13 ' A' ' 25' ' ' LEU . 78.1 t80 . . . . . 0 CA--C 1.531 0.247 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.244 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 . . . . . 0 C--O 1.224 -0.237 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 t -78.77 130.87 36.23 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -176.84 2.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.012 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mp -79.88 -57.62 3.56 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -72.92 -35.35 67.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.584 0.707 . . . . 0.0 110.7 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.27 71.1 0.73 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.165 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.532 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.4 mt -49.34 157.1 0.94 Allowed Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.077 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -37.28 163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 124.478 3.452 . . . . 0.0 115.009 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -49.52 -9.09 0.12 Allowed 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 124.146 3.23 . . . . 0.0 114.95 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.682 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.19 -36.38 65.83 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 121.98 0.112 . . . . 0.0 110.995 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.934 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.02 -78.12 0.59 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.87 -47.6 84.25 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -52.92 49.39 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.333 -0.937 . . . . 0.0 114.73 -177.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.688 ' HB2' HD23 ' A' ' 106' ' ' LEU . 15.1 tm-20 -71.94 -43.88 64.5 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.89 -39.44 87.46 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.3 p -73.97 -30.83 62.71 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 120.121 -0.632 . . . . 0.0 111.838 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.4 -56.32 3.58 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.64 -45.22 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -177.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.428 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 83.9 mt -74.51 -17.34 60.77 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.165 -0.334 . . . . 0.0 111.42 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 7.3 t70 -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.028 0.442 . . . . 0.0 110.976 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 59.1 m -88.85 10.79 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.53 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.0 t -67.49 145.2 55.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.087 0.47 . . . . 0.0 111.199 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.95 50.75 2.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.72 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.96 -12.73 69.32 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.9 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.58 98.79 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 117.285 0.542 . . . . 0.0 110.992 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -120.52 -30.49 4.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.329 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.31 118.08 1.04 Allowed Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.544 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.404 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 6.4 p90 -56.0 -43.03 77.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.057 0.428 . . . . 0.0 110.348 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.0 ptt180 -83.66 0.44 46.93 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.419 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.3 -50.2 63.77 Favored Glycine 0 CA--C 1.516 0.148 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.914 -177.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -71.99 -42.0 66.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.288 0.544 . . . . 0.0 111.496 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.58 -42.71 91.45 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.33 -45.76 92.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.286 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH2' ' HG2' ' A' ' 97' ' ' GLU . 99.7 mtt180 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.716 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 120.762 0.315 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.46 -28.15 61.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.559 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.519 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.8 mt -60.1 -44.05 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.331 0.586 . . . . 0.0 110.03 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -66.78 -37.09 83.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.249 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.96 -46.71 86.44 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.0 mt-10 -89.78 -4.28 57.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.4 p -56.87 -33.31 41.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 118.361 0.528 . . . . 0.0 111.141 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.87 -4.36 58.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.931 0.396 . . . . 0.0 110.842 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -106.58 21.61 17.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.84 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.641 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.94 21.56 9.5 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.233 -0.984 . . . . 0.0 114.282 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.641 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.1 OUTLIER 95.24 147.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.602 1.161 . . . . 0.0 111.667 177.687 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.3 t -134.8 -36.57 0.84 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.401 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.22 -66.0 2.61 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.486 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 20.6 m -86.18 -37.51 18.63 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 122.352 -0.499 . . . . 0.0 111.273 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -60.95 -47.17 87.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.1 tt0 -62.32 -42.17 99.15 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.626 0.25 . . . . 0.0 110.817 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 50' ' ' ALA . 63.2 tp -61.32 -46.24 91.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.578 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.5 mt -70.06 -39.13 75.86 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.432 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -79.57 -4.88 53.52 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.2 m -58.37 -39.77 80.47 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -86.37 -90.01 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.959 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.96 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.3 0.571 . . . . 0.0 109.724 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -111.88 -57.11 2.31 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.934 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.0 ttpp -132.24 -43.45 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.184 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.24 34.72 4.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.816 0.847 . . . . 0.0 111.647 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.36 170.89 15.11 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.6 p -122.57 158.72 29.29 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.336 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.647 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.39 -40.82 82.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.144 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.86 98.26 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.719 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.67 -45.86 88.19 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.558 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.78 -24.5 52.89 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.5 tp -60.03 -40.8 90.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.409 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.41 -43.21 99.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.937 0.399 . . . . 0.0 110.791 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.3 -40.05 77.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 121.618 0.723 . . . . 0.0 109.65 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 100' ' ' HIS . 50.1 tp -60.85 -40.47 93.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.26 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -61.66 -38.88 89.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.407 ' HG2' ' NH2' ' A' ' 52' ' ' ARG . 86.3 tt0 -62.66 -42.4 99.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 52.2 tpp -70.61 -40.0 73.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.379 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 81.75 40.09 11.2 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.578 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.662 ' HB3' HD11 ' A' ' 95' ' ' LEU . 20.7 t-160 -75.84 111.79 11.56 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.373 0.606 . . . . 0.0 110.73 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.32 -43.04 92.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.552 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.4 tpp180 -69.74 -38.72 76.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.11 -42.04 93.86 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.129 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.501 ' O ' HG22 ' A' ' 107' ' ' ILE . 46.8 pt -70.66 -27.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.868 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.82 -49.91 70.99 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.214 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' A' ' 32' ' ' GLU . 12.3 tp -83.92 -22.92 31.39 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.682 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.2 tt -61.84 -21.75 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.107 0.48 . . . . 0.0 111.148 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 54.3 m -62.17 -25.32 67.7 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.399 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -70.33 -14.15 62.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.532 ' HE1' HD22 ' A' ' 25' ' ' LEU . 72.0 t80 . . . . . 0 N--CA 1.463 0.206 0 CA-C-O 120.755 0.312 . . . . 0.0 110.587 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.3 m80 . . . . . 0 C--O 1.217 -0.64 0 N-CA-C 111.295 0.109 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -70.67 119.72 15.24 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.36 161.67 12.1 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.071 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.03 -50.5 66.0 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -81.24 -35.65 30.95 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.43 0.633 . . . . 0.0 111.341 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.52 70.77 0.72 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.627 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.514 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.3 mt -46.11 156.28 0.48 Allowed Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 123.904 0.753 . . . . 0.0 111.372 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -38.43 165.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 124.91 3.74 . . . . 0.0 114.725 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -49.33 -9.35 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.041 3.16 . . . . 0.0 114.996 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.69 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.48 -35.9 63.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.374 0.13 . . . . 0.0 110.734 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.895 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.74 -78.8 0.59 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 61.6 tp -61.42 -48.02 83.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.76 -51.52 58.14 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.654 -0.784 . . . . 0.0 114.467 -177.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.634 ' HB2' HD22 ' A' ' 106' ' ' LEU . 37.4 tp10 -70.57 -43.39 69.56 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.63 -39.34 88.24 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -71.78 -30.34 65.45 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 120.55 -0.46 . . . . 0.0 111.712 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.23 -56.75 3.38 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.3 t -64.26 -44.51 97.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.07 -19.15 61.86 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.351 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.495 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.0 t70 -59.75 -38.91 83.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 110.747 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.9 m -88.71 6.3 39.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.989 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.0 t -65.69 141.48 58.35 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.256 0.55 . . . . 0.0 111.536 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -132.68 50.68 2.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.252 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.98 -11.64 71.65 Favored Glycine 0 CA--C 1.52 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 113.49 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.8 98.52 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 117.253 0.527 . . . . 0.0 111.066 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -119.94 -23.31 6.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.909 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.47 111.69 0.2 Allowed Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.285 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 21.3 p90 -54.08 -44.4 71.14 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.235 0.518 . . . . 0.0 110.88 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.704 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.71 -0.08 52.32 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.781 178.249 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.96 -45.38 95.23 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.446 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.484 HD22 HG12 ' A' ' 94' ' ' VAL . 87.0 mt -71.55 -42.92 67.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.847 0.323 . . . . 0.0 111.163 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.808 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.34 -43.26 91.48 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.41 -40.08 95.35 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.694 -178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.781 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.982 0.42 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 12.7 t60 -73.89 -25.97 60.29 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.287 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.704 HD13 ' HB3' ' A' ' 47' ' ' ARG . 81.2 mt -59.4 -42.25 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.068 0.461 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.474 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -69.51 -27.44 65.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.029 179.343 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -70.26 -50.07 43.38 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.322 1.231 . . . . 0.0 114.322 -178.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.2 mt-10 -89.53 -3.56 58.28 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.7 p -55.54 -34.62 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 118.158 0.435 . . . . 0.0 111.308 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.17 -4.12 58.36 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.942 0.401 . . . . 0.0 110.76 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -105.68 21.88 16.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.796 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.612 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.14 22.26 8.88 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.266 -0.969 . . . . 0.0 114.363 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 94.18 140.16 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.251 1.02 . . . . 0.0 112.212 177.309 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.9 t -131.87 -25.82 2.03 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.483 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.584 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.01 -66.19 3.03 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.023 -1.084 . . . . 0.0 112.11 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.422 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 21.4 m -87.58 -36.63 17.43 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.428 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.3 ttt180 -60.37 -47.95 83.86 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.744 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.57 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.3 tt0 -63.04 -40.61 98.24 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.868 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.808 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.15 -46.16 91.68 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.3 mt -68.74 -39.37 80.36 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.241 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -78.07 -5.64 52.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.3 m -58.92 -39.74 82.46 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -85.99 -89.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.42 -86.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -114.68 -54.01 2.61 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.895 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.62 -44.9 0.89 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.8 t30 47.87 32.17 2.63 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.221 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.509 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.38 132.57 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -81.95 160.45 23.35 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.65 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.562 HG23 HD11 ' A' ' 107' ' ' ILE . 1.2 mp -60.31 -38.94 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.122 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.99 -39.04 97.59 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.726 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.32 -46.26 89.52 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.59 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.55 -24.38 45.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 -179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 107' ' ' ILE . 61.4 tp -59.45 -40.53 87.16 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.627 0.251 . . . . 0.0 111.077 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -62.29 -41.3 98.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.559 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.484 HG12 HD22 ' A' ' 49' ' ' LEU . 87.5 t -69.63 -40.19 79.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.032 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 91' ' ' LEU . 3.7 mp -59.31 -36.95 76.55 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.241 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 92' ' ' LEU . 99.0 mm-40 -62.97 -39.9 96.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.287 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -62.57 -46.08 89.98 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.789 0.328 . . . . 0.0 110.718 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.1 mmt -70.36 -36.59 74.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.15 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 101' ' ' ARG . . . 93.53 40.61 4.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.245 -0.979 . . . . 0.0 111.983 -179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -76.89 86.95 3.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.317 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 99' ' ' GLY . 1.4 mpp_? -63.18 -43.35 98.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.529 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -63.32 -39.9 95.85 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.688 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.472 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.87 -37.79 83.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.569 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.3 mt -60.21 -43.18 92.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.615 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -63.93 -43.21 96.59 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.634 HD22 ' HB2' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -84.44 -23.05 30.13 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.106 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.69 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.7 tt -64.74 -20.96 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.845 0.355 . . . . 0.0 111.632 -179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 79.7 p -69.08 -16.7 63.74 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.448 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -71.73 -14.65 62.08 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.576 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.514 ' HE1' HD22 ' A' ' 25' ' ' LEU . 63.8 t80 . . . . . 0 CA--C 1.531 0.212 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.287 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.218 -0.565 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.8 m -75.61 117.44 17.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.652 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.9 169.21 21.63 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.735 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -64.18 -50.52 67.79 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.418 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . 99.7 m-85 -91.92 -35.68 13.88 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.277 0.56 . . . . 0.0 111.133 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.9 70.76 1.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.307 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.542 HD22 ' HE2' ' A' ' 110' ' ' TYR . 94.0 mt -47.43 156.32 0.64 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.642 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.55 166.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.257 3.972 . . . . 0.0 114.977 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.89 -8.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.232 0 C-N-CA 124.112 3.208 . . . . 0.0 115.312 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.7 -36.55 67.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 118.025 0.375 . . . . 0.0 110.219 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.97 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.66 -78.37 0.59 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.9 tp -61.11 -48.72 80.35 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.07 -51.26 59.54 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 120.473 -0.87 . . . . 0.0 114.343 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.467 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.39 -43.28 70.37 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.22 -37.89 84.35 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.61 -0.436 . . . . 0.0 112.085 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.7 p -75.28 -31.7 60.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.774 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.97 -56.89 3.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.439 HG11 ' HG2' ' A' ' 102' ' ' ARG . 61.4 t -63.49 -44.77 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 100' ' ' HIS . 70.5 mt -72.84 -19.42 61.31 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.187 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.621 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 39.6 t0 -62.02 -36.19 80.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.168 0.508 . . . . 0.0 110.158 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.8 m -88.1 7.41 31.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.996 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.7 t -62.76 142.77 58.02 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.411 0.624 . . . . 0.0 111.717 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -130.35 40.0 3.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.849 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.15 -11.96 69.81 Favored Glycine 0 CA--C 1.519 0.3 0 CA-C-N 115.456 -0.793 . . . . 0.0 113.094 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.77 -42.88 97.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.967 0.383 . . . . 0.0 111.654 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 92.0 mt -113.8 -22.06 10.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.078 0.466 . . . . 0.0 110.5 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.705 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.4 p90 -52.12 -52.38 51.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 117.107 0.454 . . . . 0.0 110.641 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.55 0.64 45.7 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.752 178.095 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.74 -47.08 91.03 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.158 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 HG12 ' A' ' 94' ' ' VAL . 94.7 mt -73.38 -43.19 61.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.96 0.38 . . . . 0.0 111.376 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.709 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.72 -40.73 95.82 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -60.68 -43.74 97.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.243 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 . . . . . 0 C--O 1.232 0.145 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.881 179.683 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.837 0.351 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -68.17 -29.27 68.1 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.397 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.577 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.9 mt -60.01 -42.8 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.433 0.635 . . . . 0.0 109.63 178.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.19 -35.93 76.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.172 178.338 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -62.78 -47.59 82.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.528 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.1 mt-10 -89.56 -3.62 58.23 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.1 p -57.13 -32.48 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 118.18 0.445 . . . . 0.0 111.146 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.83 -4.67 58.43 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.922 0.391 . . . . 0.0 110.693 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -106.38 21.56 17.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.728 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.606 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 22.3 8.9 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.391 -0.909 . . . . 0.0 114.254 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 93.75 142.65 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.279 1.032 . . . . 0.0 112.129 177.512 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.6 t -130.74 -31.74 1.73 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.964 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.447 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.44 -62.99 5.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.299 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.515 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.14 -37.3 16.29 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.384 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.8 ttt180 -62.3 -47.41 84.41 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.56 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.7 tt0 -63.25 -40.02 96.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.734 0.302 . . . . 0.0 110.632 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.709 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.3 tp -61.16 -46.38 90.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.171 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.479 HD22 ' HG3' ' A' ' 84' ' ' LYS . 86.1 mt -71.17 -40.21 71.42 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.998 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -82.52 -5.94 59.03 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -59.13 -41.94 89.45 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -85.8 -89.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.48 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.19 -86.91 0.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.293 0.568 . . . . 0.0 110.596 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.418 ' OE1' ' HB2' ' A' ' 23' ' ' PHE . 91.8 mt-30 -112.46 -57.23 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.97 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.8 ttpp -131.73 -42.45 1.02 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.2 t30 49.28 30.44 3.16 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.135 0.974 . . . . 0.0 111.857 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 9.6 mptt -139.57 164.24 30.42 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.0 p -124.95 160.16 29.55 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.539 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.8 mp -59.45 -41.85 85.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.971 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.81 99.4 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.914 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.74 -40.28 95.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.629 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -74.87 -29.42 61.01 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.7 -179.58 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.566 HD21 HG12 ' A' ' 107' ' ' ILE . 74.4 mt -59.6 -37.51 78.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.97 -46.49 87.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.286 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.472 HG12 HD22 ' A' ' 49' ' ' LEU . 92.6 t -70.51 -39.57 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.727 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.0 mp -57.78 -39.47 77.55 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.35 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -63.8 -38.85 92.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.142 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -63.17 -40.6 98.0 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.913 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 95.7 mmm -90.4 -10.75 42.73 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.9 39.73 46.02 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.853 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.405 ' CD2' HD21 ' A' ' 37' ' ' LEU . 16.1 m80 -74.28 81.39 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.085 0.469 . . . . 0.0 111.579 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -63.21 -42.2 99.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.57 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.439 ' HG2' HG11 ' A' ' 36' ' ' VAL . 22.2 tpp85 -62.21 -41.55 98.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.025 0.44 . . . . 0.0 110.761 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.47 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.27 -39.17 89.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.305 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.5 mt -62.66 -42.89 97.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.631 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.16 -41.45 99.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.706 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.467 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.36 -23.51 37.67 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.599 HG22 ' O ' ' A' ' 104' ' ' ILE . 0.9 OUTLIER -64.82 -20.3 27.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.859 0.362 . . . . 0.0 111.251 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.0 p -71.03 -7.25 45.06 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.604 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -68.62 -27.1 65.73 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.758 0.313 . . . . 0.0 110.978 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.542 ' HE2' HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.223 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.223 -0.335 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.7 t -72.43 125.46 27.44 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.229 0.538 . . . . 0.0 112.422 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -167.56 -178.21 3.85 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.586 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -80.38 -58.98 2.88 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.387 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -72.9 -35.4 67.09 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.608 0.718 . . . . 0.0 110.691 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -110.56 71.33 0.75 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.092 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.604 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.3 mt -48.24 156.54 0.77 Allowed Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -36.12 163.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.632 3.555 . . . . 0.0 115.176 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -50.52 -8.9 0.16 Allowed 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 123.978 3.119 . . . . 0.0 114.634 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.688 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.17 -35.59 64.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.3 -79.5 0.58 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 62.4 tp -62.3 -47.68 83.21 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.45 -52.26 53.71 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.593 -0.813 . . . . 0.0 114.645 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -71.12 -43.23 68.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.35 -39.73 89.37 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.0 p -73.13 -30.14 63.4 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.847 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -55.82 3.81 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.63 -45.25 95.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.678 ' HB2' ' HZ1' ' A' ' 71' ' ' LYS . 82.6 mt -74.39 -17.82 60.75 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.713 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 19.3 t70 -59.56 -38.74 81.9 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.104 0.478 . . . . 0.0 110.541 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.6 p -90.29 10.04 26.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.354 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -66.5 147.24 53.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.18 0.514 . . . . 0.0 111.237 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -136.53 49.54 2.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.242 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.94 -10.3 74.77 Favored Glycine 0 CA--C 1.519 0.34 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.422 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.64 99.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 111.154 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -122.38 -32.39 3.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.17 114.92 1.4 Allowed Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.583 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.47 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 9.0 p90 -55.15 -44.17 74.86 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.036 0.418 . . . . 0.0 110.572 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.738 ' HB3' HD13 ' A' ' 63' ' ' ILE . 1.5 ppt_? -84.83 -0.5 54.14 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.728 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -48.69 83.41 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.299 -177.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 95' ' ' LEU . 95.0 mt -73.28 -41.82 63.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.9 0.381 . . . . 0.0 111.214 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.74 -43.1 97.47 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -60.73 -44.38 96.72 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.368 0.417 . . . . 0.0 111.636 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 . . . . . 0 C--N 1.332 -0.186 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 179.366 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.4 t70 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.462 0.172 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 30.4 p80 -78.69 -19.11 53.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.823 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.738 HD13 ' HB3' ' A' ' 47' ' ' ARG . 77.8 mt -61.96 -41.18 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 121.303 0.573 . . . . 0.0 110.457 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 67' ' ' VAL . 96.3 mt-10 -69.55 -34.0 73.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.995 178.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.2 mttt -62.4 -47.98 81.74 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.4 mm-40 -89.5 -4.31 57.98 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.7 p -57.11 -30.82 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 118.233 0.47 . . . . 0.0 110.894 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -88.33 -5.22 58.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.12 0.486 . . . . 0.0 110.596 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -109.36 22.91 15.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.766 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.682 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.61 11.55 30.59 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-O 118.858 -0.968 . . . . 0.0 114.633 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.682 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 105.73 147.76 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.112 1.365 . . . . 0.0 111.744 177.528 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.614 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.6 t -132.34 -26.06 1.9 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.762 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.92 -66.56 2.71 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 119.036 -1.554 . . . . 0.0 111.007 178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -87.03 -40.02 15.1 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 71' ' ' LYS . 76.0 ttt-85 -61.55 -47.91 83.41 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.9 tp10 -61.75 -43.05 99.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.515 0.198 . . . . 0.0 110.859 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.1 tp -63.59 -45.74 89.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.588 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.594 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.1 mt -67.16 -39.11 86.45 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.888 0.375 . . . . 0.0 111.178 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -78.2 -6.27 54.34 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.2 m -59.18 -39.74 83.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -85.9 -90.14 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.198 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.98 -86.49 0.5 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.168 0.509 . . . . 0.0 109.679 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -111.16 -57.61 2.22 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.2 ttpp -133.13 -42.76 0.88 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.71 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.0 t30 49.4 32.84 4.89 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.153 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.59 130.4 26.07 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.72 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 51.5 p -81.55 160.2 23.94 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.991 -0.683 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.5 -38.4 77.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.041 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.4 -39.32 97.62 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.915 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.98 -45.19 93.58 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.655 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -78.01 -23.94 48.1 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.397 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 107' ' ' ILE . 62.2 tp -58.98 -40.92 86.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.087 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -61.92 -41.48 97.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 110.265 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 76.5 t -67.98 -41.55 84.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.154 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.5 mp -60.15 -39.21 85.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.119 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -62.94 -40.63 98.23 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -65.19 -42.89 93.17 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.566 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.43 -38.56 81.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.196 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.69 26.15 39.51 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.612 -0.804 . . . . 0.0 113.464 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.413 ' NE2' ' HB3' ' A' ' 102' ' ' ARG . 20.7 t-160 -77.48 106.16 9.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.098 0.449 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.96 -42.23 97.33 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.413 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.2 tpp180 -62.57 -42.25 99.43 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.865 0.364 . . . . 0.0 110.96 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.63 -42.04 98.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.497 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.653 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.2 mt -64.24 -43.28 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.38 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -61.0 -47.96 84.03 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.443 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -76.99 -24.94 52.22 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.688 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.9 tt -64.7 -20.68 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 120.816 0.341 . . . . 0.0 111.723 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 72.2 p -75.62 -8.09 55.92 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.595 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -87.49 16.09 5.88 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.029 0.442 . . . . 0.0 111.238 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.604 ' HE1' HD22 ' A' ' 25' ' ' LEU . 58.9 t80 . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.672 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 120.457 0.17 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -70.79 120.03 15.8 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.12 164.45 20.29 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.484 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.43 -50.37 70.03 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.62 -35.36 14.27 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.143 0.496 . . . . 0.0 111.589 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -103.61 70.8 1.04 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.46 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.0 mt -43.51 157.51 0.26 Allowed Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 124.283 0.989 . . . . 0.0 112.454 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -42.32 167.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 124.621 3.547 . . . . 0.0 113.845 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.73 -9.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.821 3.014 . . . . 0.0 115.083 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.5 -35.36 67.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.868 0.303 . . . . 0.0 110.937 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.834 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.0 tp -107.24 -77.55 0.6 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -49.75 71.11 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.34 -52.29 54.08 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.559 -0.829 . . . . 0.0 115.049 -177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.8 tm-20 -71.28 -43.82 66.42 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.68 -39.58 88.2 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 19.2 p -74.32 -32.97 63.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.191 -0.604 . . . . 0.0 112.17 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.7 -54.52 4.48 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.458 HG11 ' HG2' ' A' ' 102' ' ' ARG . 56.9 t -64.19 -44.83 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.512 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 mt -75.64 -17.23 60.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.37 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.634 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 36.5 t0 -60.66 -37.13 80.56 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.054 0.454 . . . . 0.0 110.967 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.9 m -85.72 9.6 15.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.128 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.426 ' SG ' HD12 ' A' ' 44' ' ' LEU . 48.3 t -66.18 144.66 56.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.254 0.549 . . . . 0.0 111.883 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -133.63 46.26 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.87 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.4 -11.99 70.51 Favored Glycine 0 CA--C 1.519 0.33 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.391 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.82 -42.46 97.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.956 0.407 . . . . 0.0 111.551 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.426 HD12 ' SG ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -117.05 -26.15 6.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.308 179.095 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.403 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.63 108.07 0.25 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.165 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 16.0 p90 -54.89 -40.3 69.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 117.211 0.505 . . . . 0.0 111.125 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.607 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -83.04 1.06 41.99 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.996 178.769 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.71 -43.52 96.31 Favored Glycine 0 C--N 1.329 0.177 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.713 -178.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.561 HD12 ' HB ' ' A' ' 74' ' ' THR . 94.2 mt -71.41 -42.4 68.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.768 0.318 . . . . 0.0 111.003 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.54 -40.59 93.06 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.03 -41.11 97.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.996 -178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.854 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 120.992 0.425 . . . . 0.0 110.672 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -74.38 -22.43 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.419 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.607 HD13 ' HB3' ' A' ' 47' ' ' ARG . 80.6 mt -59.86 -43.73 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.11 0.481 . . . . 0.0 110.5 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.517 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.9 mt-10 -66.94 -36.58 82.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.957 0.408 . . . . 0.0 110.935 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.34 -47.2 83.15 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -177.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 6.1 mt-10 -90.05 -4.08 57.59 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.1 p -56.54 -32.62 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.209 0.459 . . . . 0.0 111.235 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.82 -4.73 58.41 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.853 178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -106.08 21.31 17.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.907 -178.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.64 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.62 21.15 10.01 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.259 -0.972 . . . . 0.0 114.233 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.64 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 98.9 148.01 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.568 1.147 . . . . 0.0 112.04 177.479 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.1 t -137.13 -37.26 0.65 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.659 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.649 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.68 -62.8 4.94 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.931 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.561 ' HB ' HD12 ' A' ' 49' ' ' LEU . 9.2 t -88.21 -36.06 16.99 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.266 0.533 . . . . 0.0 111.712 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.18 -47.27 85.24 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.2 tt0 -62.58 -40.14 95.93 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.645 0.26 . . . . 0.0 110.641 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.7 tp -61.51 -46.96 87.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.531 HD22 ' HG3' ' A' ' 84' ' ' LYS . 91.1 mt -72.26 -39.88 68.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.566 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -78.09 -6.77 55.71 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.9 p -57.86 -38.63 76.05 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -87.38 -91.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.016 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.94 -86.8 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -108.7 -57.87 2.08 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.834 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.2 ttpp -133.07 -43.84 0.87 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.94 176.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.2 t30 47.97 34.7 4.3 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.556 0.742 . . . . 0.0 111.911 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -139.45 168.14 20.49 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 64.8 p -124.84 158.59 33.07 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.528 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 29' ' ' LEU . 1.2 mm -60.56 -37.66 75.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.924 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.91 -41.35 99.27 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.716 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.47 -42.34 83.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.057 0.456 . . . . 0.0 111.036 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -75.59 -24.14 56.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.802 -179.476 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.52 -42.14 91.57 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.945 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -62.09 -41.59 98.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.433 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -69.09 -41.24 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.062 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.706 HD13 HD12 ' A' ' 91' ' ' LEU . 2.0 mp -59.91 -42.96 95.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.253 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -63.9 -40.8 97.33 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.204 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -63.95 -46.71 83.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.4 mmm -70.29 -38.57 75.04 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.73 40.0 5.41 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.446 -0.883 . . . . 0.0 113.266 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.416 ' CE1' ' HB3' ' A' ' 44' ' ' LEU . 99.0 m-70 -78.44 97.18 5.58 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.994 0.397 . . . . 0.0 110.588 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.526 ' O ' HG12 ' A' ' 104' ' ' ILE . 83.6 mtp180 -63.67 -41.83 98.13 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.691 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.458 ' HG2' HG11 ' A' ' 36' ' ' VAL . 6.5 tpm_? -65.41 -37.56 87.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.044 0.449 . . . . 0.0 111.666 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.31 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.681 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.619 ' O ' HG22 ' A' ' 107' ' ' ILE . 36.9 pt -69.03 -25.76 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.429 -179.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -70.56 -39.97 73.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.863 0.364 . . . . 0.0 110.717 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.427 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -84.93 -22.8 29.11 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.737 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -61.97 -21.18 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.642 0.258 . . . . 0.0 111.328 -179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.4 t -65.77 -16.71 64.04 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.598 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -78.1 -10.44 59.62 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 0.0 111.421 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.528 179.026 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.219 -0.535 0 N-CA-C 111.442 0.164 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.418 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.4 m -78.64 113.91 17.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.504 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 20.6 mt -155.96 165.58 36.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.005 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.6 tp -62.77 -49.46 74.91 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -83.27 -35.39 25.35 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.156 0.503 . . . . 0.0 112.007 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -113.09 71.23 0.74 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.703 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.44 HD13 ' CE1' ' A' ' 110' ' ' TYR . 86.1 mt -41.0 155.4 0.21 Allowed Pre-proline 0 CA--C 1.54 0.577 0 O-C-N 123.926 0.766 . . . . 0.0 112.008 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.2 Cg_exo -38.01 164.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 125.041 3.827 . . . . 0.0 114.848 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.21 -9.17 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 124.131 3.221 . . . . 0.0 115.18 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.607 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.94 -35.55 64.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 117.634 0.197 . . . . 0.0 110.521 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.91 -79.12 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.21 -47.44 84.42 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.51 -51.12 60.69 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.523 -0.846 . . . . 0.0 114.14 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.96 -43.26 68.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.59 -38.68 84.38 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -73.97 -30.85 62.72 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.644 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.5 -57.35 3.1 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.66 -45.58 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 HD12 ' A' ' 49' ' ' LEU . 84.0 mt -72.61 -19.51 61.45 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.485 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 37.0 t0 -61.29 -37.29 82.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 110.28 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -85.69 1.65 48.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.014 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -63.45 139.34 58.76 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.224 0.535 . . . . 0.0 111.553 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.52 45.78 2.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.938 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.04 -10.96 73.01 Favored Glycine 0 CA--C 1.52 0.35 0 CA-C-N 115.535 -0.757 . . . . 0.0 113.127 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.11 98.76 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.994 0.397 . . . . 0.0 111.347 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.439 ' HG ' ' CD2' ' A' ' 100' ' ' HIS . 1.9 mm? -114.68 -23.6 9.15 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.78 110.37 0.3 Allowed Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.393 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.9 p90 -50.95 -50.35 58.11 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 117.293 0.546 . . . . 0.0 110.627 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.656 ' HB3' HG21 ' A' ' 63' ' ' ILE . 47.0 ptt85 -84.04 1.33 44.41 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.694 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.91 -49.11 73.56 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.3 -177.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.511 HD12 HD11 ' A' ' 37' ' ' LEU . 95.9 mt -71.25 -41.63 69.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.073 0.437 . . . . 0.0 111.372 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.68 -41.4 96.08 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -60.55 -42.63 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.934 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.106 179.93 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 121.174 0.511 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -70.74 -27.72 64.16 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.842 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.656 HG21 ' HB3' ' A' ' 47' ' ' ARG . 79.1 mt -59.97 -42.71 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.129 0.49 . . . . 0.0 110.572 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.4 mt-10 -65.92 -36.53 83.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.458 . . . . 0.0 110.847 178.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.53 -49.14 74.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.551 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 1.4 mm-40 -89.95 -3.45 58.03 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 6.2 p -56.18 -33.42 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 118.177 0.444 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.05 -4.34 58.4 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.808 0.337 . . . . 0.0 110.762 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.97 21.57 17.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.883 -178.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.86 20.79 10.24 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.282 -0.961 . . . . 0.0 114.269 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.0 OUTLIER 95.82 141.52 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.388 1.075 . . . . 0.0 112.161 177.493 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.7 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.4 t -131.12 -28.8 1.9 Allowed 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.331 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.486 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.23 -63.14 5.58 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.745 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.505 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.84 -40.12 13.36 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 179.224 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.55 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 76.9 ttt180 -62.31 -49.89 73.83 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -177.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.7 ' HB3' ' O ' ' A' ' 72' ' ' SER . 52.4 tp10 -64.51 -39.19 93.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.295 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.578 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.0 tp -60.51 -46.52 89.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.937 0.399 . . . . 0.0 110.338 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.487 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.7 mt -71.5 -39.59 70.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.195 0.522 . . . . 0.0 111.197 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -74.55 -6.47 48.65 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.616 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 t -58.03 -42.1 84.63 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 61.5 m95 -85.73 -90.05 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.988 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.71 -86.26 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.216 0.532 . . . . 0.0 109.575 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.48 -56.95 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.921 ' HD2' HD23 ' A' ' 29' ' ' LEU . 21.5 ttpp -132.02 -42.68 0.99 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.482 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 45.63 34.01 1.6 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.669 0.788 . . . . 0.0 112.563 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.5 169.01 18.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.3 p -119.38 158.32 26.41 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.469 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.23 -38.26 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.057 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.31 -39.6 97.95 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.824 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.83 -46.53 87.5 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.752 0.279 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.681 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.2 mm? -76.32 -24.49 54.31 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.286 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.07 -38.1 78.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -60.93 -41.83 96.98 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.839 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.09 -23.95 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.121 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.8 mp -62.78 -46.61 87.21 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 110.334 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.69 -39.44 91.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.626 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -63.29 -43.5 97.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.652 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -68.69 -38.75 80.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.88 22.86 19.51 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.095 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.439 ' CD2' ' HG ' ' A' ' 44' ' ' LEU . 13.1 t-160 -78.08 99.02 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.087 0.47 . . . . 0.0 110.996 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.69 -40.8 96.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.809 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.19 -41.4 96.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.856 0.36 . . . . 0.0 110.739 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -39.49 90.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.304 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.627 ' O ' HG22 ' A' ' 107' ' ' ILE . 44.2 mm -63.97 -43.66 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.749 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -64.64 -40.78 96.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.648 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -79.79 -22.78 42.72 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.627 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.5 tp -64.55 -20.84 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.511 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.1 p -74.09 -10.18 59.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -89.03 16.28 7.32 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.195 0.522 . . . . 0.0 111.187 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.44 ' CE1' HD13 ' A' ' 25' ' ' LEU . 38.7 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.307 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 C--O 1.221 -0.398 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.2 m -67.64 119.66 12.76 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.74 0.305 . . . . 0.0 111.72 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.17 163.3 22.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.428 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.0 tp -64.38 -50.58 67.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -85.25 -35.38 21.6 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.565 0.697 . . . . 0.0 111.325 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.5 70.44 0.73 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.348 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.7 mt -45.84 155.52 0.49 Allowed Pre-proline 0 N--CA 1.466 0.356 0 O-C-N 124.161 0.913 . . . . 0.0 111.387 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -35.4 160.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 124.683 3.589 . . . . 0.0 114.888 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -49.39 -9.17 0.11 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.338 3.359 . . . . 0.0 114.889 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.32 -35.05 62.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.71 0.232 . . . . 0.0 110.676 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.928 HD23 ' HD2' ' A' ' 84' ' ' LYS . 7.5 tp -107.85 -78.28 0.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -61.32 -48.73 80.01 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.64 -52.73 48.93 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.676 -0.773 . . . . 0.0 114.817 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -72.2 -42.01 66.27 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 95' ' ' LEU . 92.6 mt -65.4 -38.76 90.93 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.675 -179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.6 p -72.15 -29.46 64.06 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.357 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 38' ' ' ASP . . . -85.53 -59.42 2.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.03 -44.44 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 33' ' ' LEU . 89.6 mt -70.81 -19.17 62.7 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.649 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 13.6 t70 -60.99 -37.15 81.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.982 0.42 . . . . 0.0 110.625 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 m -81.22 1.56 31.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 50.3 t -64.16 139.01 58.72 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.316 0.579 . . . . 0.0 111.916 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -129.4 43.67 3.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.358 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 95.26 -13.84 66.16 Favored Glycine 0 CA--C 1.521 0.424 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.791 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.88 97.12 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.762 0.315 . . . . 0.0 111.704 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.61 -17.34 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.113 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 72.49 105.54 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.549 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.476 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 7.8 p90 -51.63 -52.51 47.19 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.361 0.581 . . . . 0.0 110.338 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HB3' HG21 ' A' ' 63' ' ' ILE . 49.1 ptt85 -84.7 -0.32 53.14 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.651 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.41 -39.05 92.34 Favored Glycine 0 N--CA 1.46 0.276 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.87 -178.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.455 HD11 HD13 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -85.15 -45.41 12.08 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.787 0.327 . . . . 0.0 110.713 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.58 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -62.78 -40.49 97.48 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -61.41 -41.16 96.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.011 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 . . . . . 0 C--O 1.232 0.175 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.368 179.716 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.695 0.283 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.7 p-80 -85.68 -14.71 44.64 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.575 ' O ' ' HB3' ' A' ' 72' ' ' SER . 76.4 mt -59.8 -40.43 82.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 121.406 0.622 . . . . 0.0 109.518 178.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.455 ' O ' HG12 ' A' ' 67' ' ' VAL . 97.6 mt-10 -72.13 -21.33 61.48 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.601 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -73.85 -52.7 12.18 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 18.1 mt-10 -86.85 -3.51 59.08 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.2 p -57.36 -34.31 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.914 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -89.58 -4.52 57.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.07 0.462 . . . . 0.0 110.571 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -107.12 22.75 15.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.717 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 105.11 20.4 9.8 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.302 -0.951 . . . . 0.0 114.037 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 92.79 141.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.364 1.065 . . . . 0.0 112.155 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.575 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.2 t -130.18 -28.64 2.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.037 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.28 -64.49 4.34 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.072 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.453 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -87.68 -36.33 17.48 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.8 ttt180 -61.66 -47.98 82.89 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.622 -178.303 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 13.3 tm-20 -62.55 -40.71 97.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.62 0.248 . . . . 0.0 110.647 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.58 HD22 ' HA ' ' A' ' 50' ' ' ALA . 63.4 tp -60.55 -46.65 89.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.524 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.4 mt -70.37 -39.11 74.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.89 0.376 . . . . 0.0 111.721 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -78.35 -4.93 50.55 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.9 m -58.12 -40.16 80.54 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -86.54 -90.39 0.11 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.983 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.3 -86.92 0.5 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.6 -56.97 2.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.928 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.54 -43.7 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.2 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 t30 48.03 35.74 5.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.702 0.801 . . . . 0.0 111.605 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.43 171.24 14.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.713 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.3 p -123.78 158.42 31.79 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.221 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.63 -41.28 84.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.268 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -39.8 98.14 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.815 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.47 -45.89 88.72 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.526 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -76.28 -24.88 54.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.456 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 107' ' ' ILE . 62.5 tp -58.96 -41.3 87.17 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.177 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.13 -42.81 99.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.855 0.359 . . . . 0.0 110.956 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 79.5 t -70.52 -43.63 77.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.294 0.569 . . . . 0.0 110.696 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 33' ' ' LEU . 7.1 mp -61.83 -38.62 88.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.199 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -60.09 -39.98 88.02 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -62.77 -44.51 95.99 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.424 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.4 mmm -69.87 -38.89 76.54 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 104.32 42.6 1.87 Allowed Glycine 0 CA--C 1.523 0.55 0 C-N-CA 119.79 -1.195 . . . . 0.0 113.291 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.726 ' HB2' ' HB3' ' A' ' 103' ' ' ALA . 26.8 p-80 -56.78 111.67 1.09 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.181 0.515 . . . . 0.0 112.355 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -85.4 -64.37 1.17 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -65.94 -35.87 81.79 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.043 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.726 ' HB3' ' HB2' ' A' ' 100' ' ' HIS . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.557 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.492 ' O ' HG22 ' A' ' 107' ' ' ILE . 87.1 mt -60.13 -40.54 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 121.205 0.526 . . . . 0.0 109.878 178.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -59.45 -48.34 82.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.561 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.5 -25.46 28.82 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.52 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.629 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 13.1 tt -61.59 -20.71 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 122.166 -0.334 . . . . 0.0 111.315 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.3 p -71.8 -10.15 59.35 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.384 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.93 -27.71 66.0 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 111.051 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.498 ' HE1' HD22 ' A' ' 25' ' ' LEU . 82.2 t80 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 120.881 0.372 . . . . 0.0 110.072 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 . . . . . 0 C--O 1.221 -0.413 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.1 m -66.88 114.98 6.14 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.747 0.308 . . . . 0.0 111.771 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.71 174.2 9.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.729 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.84 -57.63 3.56 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -72.24 -35.85 68.94 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.532 0.682 . . . . 0.0 110.808 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -111.85 69.96 0.7 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.243 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -46.34 156.02 0.52 Allowed Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.451 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.53 163.5 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 124.854 3.703 . . . . 0.0 114.635 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.77 -8.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 124.386 3.39 . . . . 0.0 115.027 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.706 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.87 -35.85 64.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.919 0.327 . . . . 0.0 110.532 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.9 tp -108.1 -78.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.55 -47.35 85.94 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -177.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.89 -52.2 49.95 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.692 -0.766 . . . . 0.0 114.988 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.447 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 32.3 tp10 -72.71 -43.7 62.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.11 -40.72 94.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.435 -0.506 . . . . 0.0 112.324 -178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 67.6 m -70.79 -43.84 67.86 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.45 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.75 -50.48 24.23 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.17 -43.38 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.584 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 84.7 mt -78.77 -15.9 57.85 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.626 -179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.4 t70 -58.77 -39.46 81.06 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.148 0.499 . . . . 0.0 110.8 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.5 m -90.53 10.03 27.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.023 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.1 t -68.13 142.43 55.76 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -137.92 57.66 1.71 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.178 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.46 -10.97 73.2 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.554 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.33 98.19 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.255 0.527 . . . . 0.0 111.019 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -126.14 -32.87 2.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.88 115.39 1.83 Allowed Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.625 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.6 p90 -54.38 -46.08 72.97 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.226 0.513 . . . . 0.0 110.846 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.404 ' HB3' HD13 ' A' ' 63' ' ' ILE . 46.9 ptt85 -83.49 -0.09 48.67 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 177.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.73 -47.65 89.19 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.297 -0.954 . . . . 0.0 113.465 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.3 mt -72.15 -42.66 65.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.055 0.427 . . . . 0.0 111.217 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.48 -39.87 92.45 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.19 -44.34 95.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.311 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 . . . . . 0 N--CA 1.465 0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.026 179.801 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 CA--C 1.531 0.231 0 CA-C-O 120.585 0.231 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.7 t60 -73.87 -28.25 61.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.632 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.632 ' O ' ' HB3' ' A' ' 72' ' ' SER . 85.2 mt -59.54 -41.55 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 121.289 0.566 . . . . 0.0 110.32 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.473 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.9 mm-40 -67.09 -34.96 78.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 178.491 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.4 mttt -62.53 -49.21 76.24 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -177.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.2 mt-10 -89.47 -3.64 58.29 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -54.86 -28.7 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 118.116 0.416 . . . . 0.0 111.502 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.68 -4.73 58.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 111.179 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -106.47 22.32 16.0 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.895 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.727 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 12.01 30.72 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-O 118.567 -1.129 . . . . 0.0 113.605 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.727 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.8 tppp? 108.34 149.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.97 1.308 . . . . 0.0 112.227 177.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -134.36 -19.79 1.9 Allowed 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.495 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -60.78 -67.76 1.98 Allowed Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.605 -1.283 . . . . 0.0 111.72 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 m -88.11 -33.85 18.11 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.508 -0.407 . . . . 0.0 111.057 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -61.44 -45.74 93.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.839 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.9 tt0 -61.68 -41.57 97.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.602 0.239 . . . . 0.0 110.477 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -61.76 -46.24 90.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.533 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.5 mt -67.69 -39.23 84.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.872 0.368 . . . . 0.0 111.145 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -80.96 -4.94 56.75 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.2 m -58.45 -40.05 81.58 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -86.26 -89.61 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -86.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.121 0.486 . . . . 0.0 109.745 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -114.29 -54.64 2.57 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 18.5 ttpp -132.26 -43.9 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.6 t30 47.41 34.87 3.57 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.826 0.85 . . . . 0.0 111.703 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.449 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.29 170.79 15.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.648 -179.1 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.0 p -122.86 158.6 29.94 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.036 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.456 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -59.39 -38.18 73.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.08 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.57 98.13 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.104 -0.57 . . . . 0.0 112.756 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.22 -46.43 87.03 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.649 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.1 mm? -74.18 -24.13 59.33 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.154 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.6 tp -59.16 -37.66 77.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.061 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.0 -41.69 97.02 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.836 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.65 -23.26 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.183 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.6 mp -63.42 -41.09 98.7 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 109.843 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -65.77 -37.75 87.17 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.558 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -61.65 -40.52 95.2 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.68 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.4 mmt -89.42 -12.97 38.73 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.608 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.83 37.97 65.83 Favored Glycine 0 CA--C 1.52 0.401 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.748 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.474 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 19.3 t-160 -78.05 95.29 4.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.318 0.559 . . . . 0.0 110.218 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.63 -40.86 96.21 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.096 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -61.19 -39.89 91.89 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.688 0.28 . . . . 0.0 111.291 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.521 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -38.78 88.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.397 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.576 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -62.15 -42.95 97.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.953 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -63.38 -40.8 98.22 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.456 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.16 -21.77 31.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.706 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.7 tp -61.72 -21.0 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 120.696 0.284 . . . . 0.0 111.514 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.5 t -67.86 -13.94 62.55 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -74.29 -10.82 59.97 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 111.665 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 68.2 t80 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.033 0.444 . . . . 0.0 111.143 179.256 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.8 m80 . . . . . 0 C--O 1.219 -0.535 0 CA-C-O 120.262 0.077 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.508 HG23 ' HD3' ' A' ' 26' ' ' PRO . 32.4 m -76.42 122.6 24.75 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.29 166.88 20.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.438 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.5 tp -63.66 -49.81 71.76 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.84 -33.73 22.81 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.344 0.593 . . . . 0.0 111.292 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.3 72.47 0.78 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.529 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.2 mt -46.73 156.83 0.5 Allowed Pre-proline 0 CA--C 1.541 0.599 0 O-C-N 123.415 0.447 . . . . 0.0 111.282 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.3 Cg_exo -37.78 162.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.364 1.342 0 C-N-CA 124.877 3.718 . . . . 0.0 115.126 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.13 -9.35 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 124.338 3.359 . . . . 0.0 115.11 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.38 -35.02 62.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.825 0.284 . . . . 0.0 110.998 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.824 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.1 tp -108.49 -78.28 0.59 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.66 -48.44 80.79 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.9 -51.74 56.72 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.645 -0.788 . . . . 0.0 114.249 -178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -70.21 -44.03 69.47 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.403 HD21 HD21 ' A' ' 95' ' ' LEU . 96.2 mt -68.39 -39.0 81.84 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.4 p -71.82 -30.93 66.01 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.689 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.14 -56.76 3.38 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.69 -44.71 96.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.85 -18.04 61.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.607 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.447 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 12.7 t70 -58.41 -38.56 77.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 110.755 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.5 m -90.39 7.72 37.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.095 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.0 t -65.75 140.63 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.229 0.537 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -135.46 54.61 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.145 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.66 -10.58 73.8 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 115.692 -0.685 . . . . 0.0 113.607 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.52 98.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 117.255 0.528 . . . . 0.0 111.007 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -123.4 -26.63 4.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.76 114.86 0.83 Allowed Glycine 0 N--CA 1.444 -0.78 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.755 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.409 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 p90 -53.58 -46.47 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.191 0.495 . . . . 0.0 110.403 178.484 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.438 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.8 ptt85 -83.75 1.33 43.32 Favored 'General case' 0 C--O 1.213 -0.865 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.797 177.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.9 -44.86 94.22 Favored Glycine 0 C--O 1.23 -0.134 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.252 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.456 HD21 HD23 ' A' ' 95' ' ' LEU . 93.1 mt -72.88 -43.51 62.42 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.036 0.418 . . . . 0.0 111.194 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.763 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.37 -39.55 92.42 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.48 -42.87 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.048 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.132 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.544 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.461 0.123 0 CA-C-O 120.863 0.363 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 15.0 t60 -84.04 -18.38 37.21 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.24 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.503 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -60.41 -41.49 87.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.089 0.471 . . . . 0.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.515 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -64.64 -38.68 91.84 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 33.5 mttm -65.89 -46.15 79.43 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -177.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.98 -3.81 57.8 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.3 p -56.11 -35.59 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-N 118.18 0.446 . . . . 0.0 111.392 -179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.36 -4.62 58.0 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.966 0.412 . . . . 0.0 110.862 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -104.83 22.21 15.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.869 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.54 21.48 9.22 Favored Glycine 0 CA--C 1.52 0.375 0 C-N-CA 120.409 -0.901 . . . . 0.0 114.191 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.31 141.13 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.302 1.041 . . . . 0.0 112.004 177.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.543 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.6 t -130.73 -30.74 1.82 Allowed 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.236 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.54 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.65 -64.33 4.43 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.309 -0.948 . . . . 0.0 112.316 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.486 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 22.8 m -87.74 -38.53 15.71 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 122.725 -0.279 . . . . 0.0 111.692 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.515 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.5 ttt180 -60.54 -48.36 82.13 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.543 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -63.29 -39.68 95.24 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.772 0.32 . . . . 0.0 110.677 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.763 HD22 ' HA ' ' A' ' 50' ' ' ALA . 56.9 tp -61.08 -46.85 88.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.559 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.447 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 88.2 mt -71.31 -39.13 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.1 0.476 . . . . 0.0 111.19 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -76.25 -7.03 53.99 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -178.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.7 p -57.66 -38.94 75.94 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 m95 -87.62 -89.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.484 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -87.22 0.49 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -115.63 -52.37 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.824 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.5 ttpm? -132.25 -44.75 0.93 Allowed 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.0 t30 47.09 35.85 3.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.503 0.721 . . . . 0.0 111.307 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.32 16.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.986 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 61.9 p -119.27 155.24 32.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.462 HG23 HD11 ' A' ' 107' ' ' ILE . 1.7 mp -59.68 -39.72 80.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.608 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.93 -39.21 97.24 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.743 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.17 -45.84 89.94 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.607 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.68 -23.88 53.19 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.494 HD13 HD13 ' A' ' 107' ' ' ILE . 62.8 tp -59.01 -41.65 88.25 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.037 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.2 -41.25 98.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.606 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.17 -40.25 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.174 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.456 HD23 HD21 ' A' ' 49' ' ' LEU . 81.5 mt -61.62 -36.94 82.19 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.27 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -60.92 -39.68 90.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.854 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -63.44 -44.2 95.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.936 0.398 . . . . 0.0 110.408 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 37.4 mmt -68.87 -36.56 78.25 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.956 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.53 30.17 27.93 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.525 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -74.41 97.33 3.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.147 0.498 . . . . 0.0 110.927 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.33 -41.66 96.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.663 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -62.16 -41.33 98.2 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.901 0.381 . . . . 0.0 110.872 -179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.93 -39.11 88.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.24 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 41.2 mm -62.41 -43.67 98.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.794 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -63.55 -42.08 98.41 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -83.93 -22.96 31.35 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.634 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.6 tt -66.09 -20.54 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 120.84 0.353 . . . . 0.0 111.429 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.1 p -70.47 -10.94 60.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.836 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -69.87 -26.33 64.14 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 0.0 110.917 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.6 t80 . . . . . 0 CA--C 1.531 0.228 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.237 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.4 m80 . . . . . 0 C--O 1.221 -0.418 0 N-CA-C 111.356 0.132 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 t -70.37 114.14 8.2 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -163.7 175.03 10.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.6 178.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mp -80.31 -57.87 3.4 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -71.51 -36.13 70.97 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.623 0.725 . . . . 0.0 110.589 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -112.42 69.76 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.334 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD13 ' CE1' ' A' ' 110' ' ' TYR . 83.8 mt -47.14 157.46 0.5 Allowed Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.824 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -39.71 165.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 124.86 3.707 . . . . 0.0 114.182 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.85 -9.36 0.15 Allowed 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.932 3.088 . . . . 0.0 114.979 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.495 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.18 -35.29 67.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.773 0.26 . . . . 0.0 110.933 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.887 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.1 tp -107.88 -77.8 0.59 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -49.38 73.73 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -51.79 56.85 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.404 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.5 tm-20 -71.28 -43.49 67.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.496 HD13 HG21 ' A' ' 74' ' ' THR . 83.8 mt -67.86 -38.86 83.62 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -178.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.8 p -74.18 -32.1 62.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.822 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.96 -56.33 3.53 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.43 -45.25 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.8 -17.9 61.53 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.056 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.0 t70 -59.22 -37.79 78.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.979 0.419 . . . . 0.0 110.892 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.6 m -86.98 6.51 31.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.193 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.14 142.03 58.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.206 0.527 . . . . 0.0 111.458 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -131.42 46.19 2.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.155 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.12 -11.79 71.2 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.637 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.16 -43.32 98.6 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.099 0.476 . . . . 0.0 111.059 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -114.67 -24.89 8.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.296 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.76 113.96 0.26 Allowed Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.222 -178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.5 p90 -53.03 -46.01 68.24 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 117.429 0.614 . . . . 0.0 110.388 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.3 ptt85 -84.01 1.3 44.46 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.012 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.77 -50.87 60.54 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.952 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.436 HD13 HD11 ' A' ' 91' ' ' LEU . 96.5 mt -71.86 -41.87 67.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.281 0.54 . . . . 0.0 111.302 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.16 -41.52 94.6 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -59.92 -44.11 94.51 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.19 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.039 179.866 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.527 0.076 0 CA-C-O 120.886 0.374 . . . . 0.0 110.59 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -73.55 -24.95 60.18 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.287 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.555 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.19 -40.27 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.198 0.523 . . . . 0.0 110.678 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -69.77 -20.67 63.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.571 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.91 -52.49 8.77 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 3.7 mt-10 -86.48 -3.38 59.0 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.2 p -55.52 -34.81 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 117.947 0.34 . . . . 0.0 111.134 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.14 -4.59 58.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.774 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -105.12 21.94 16.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.614 -178.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.614 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.5 22.79 8.33 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 114.223 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.614 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.93 139.05 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.389 1.076 . . . . 0.0 112.17 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.555 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -131.4 -20.79 2.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.696 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.405 ' H ' ' HD3' ' A' ' 71' ' ' LYS . . . -60.65 -67.57 2.07 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.832 -1.175 . . . . 0.0 111.669 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.496 HG21 HD13 ' A' ' 33' ' ' LEU . 10.7 m -87.78 -35.03 18.09 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 122.612 -0.346 . . . . 0.0 111.573 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.2 ttt180 -60.86 -47.76 84.89 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.496 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.9 tt0 -62.5 -40.51 96.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.689 0.281 . . . . 0.0 110.908 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 50' ' ' ALA . 63.3 tp -62.0 -47.15 86.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.834 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.556 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.2 mt -71.05 -39.85 72.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.056 0.455 . . . . 0.0 111.483 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 26.2 t-105 -77.83 -6.89 55.66 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.368 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -58.59 -42.16 87.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 60.1 m95 -85.63 -89.09 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.08 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.93 -86.59 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.176 0.512 . . . . 0.0 109.725 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -113.98 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.887 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.7 ttpp -131.92 -43.97 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.005 175.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.3 t30 48.09 31.48 2.52 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.099 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.453 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.27 169.51 17.64 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.293 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 78.4 p -127.28 160.07 32.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.757 HG23 HD11 ' A' ' 107' ' ' ILE . 4.4 mm -59.44 -38.64 76.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.151 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.18 96.61 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.628 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -66.42 -43.84 84.6 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.819 0.343 . . . . 0.0 111.09 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -74.5 -29.1 61.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.42 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.05 -41.03 82.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.05 -43.19 99.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.976 0.417 . . . . 0.0 110.616 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 84.6 t -70.87 -41.17 77.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.527 0.68 . . . . 0.0 110.227 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 100' ' ' HIS . 61.0 tp -60.82 -40.95 94.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.06 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.95 -39.56 89.97 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.951 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -64.5 -43.29 94.59 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.564 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 54.0 tpp -69.25 -39.99 78.14 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.182 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.48 40.31 23.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.792 -0.718 . . . . 0.0 114.687 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.401 ' HB3' HD11 ' A' ' 95' ' ' LEU . 9.4 t60 -80.92 112.83 18.67 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.631 0.715 . . . . 0.0 110.227 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.9 mmm180 -64.06 -42.44 97.01 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -62.23 -39.67 93.58 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.1 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.46 84.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.528 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.4 mt -61.32 -43.16 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.455 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' HIS . . . . . 0.476 ' O ' HG22 ' A' ' 108' ' ' THR . 85.6 m-70 -64.84 -39.46 93.6 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.86 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -82.85 -30.42 28.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.529 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.757 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -62.54 -22.67 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 105' ' ' HIS . 6.0 t -68.77 -6.73 28.33 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -89.02 3.2 52.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 111.457 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.582 ' CE1' HD13 ' A' ' 25' ' ' LEU . 79.2 t80 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 0.0 109.989 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.1 m80 . . . . . 0 C--O 1.218 -0.601 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.3 t -81.9 119.27 23.72 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.47 172.02 19.09 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.4 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.6 tp -63.22 -50.34 70.63 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -178.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -91.48 -35.5 14.29 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.449 0.642 . . . . 0.0 110.904 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.79 71.0 1.04 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.082 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.449 HD13 ' CE1' ' A' ' 110' ' ' TYR . 93.6 mt -47.57 156.33 0.67 Allowed Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.717 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -39.33 165.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 125.068 3.846 . . . . 0.0 114.716 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.26 -8.78 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.296 3.331 . . . . 0.0 115.347 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.29 -36.4 66.12 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.118 0.417 . . . . 0.0 110.456 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.917 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -107.76 -77.93 0.59 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -52.55 65.0 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -49.45 78.41 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.684 -0.77 . . . . 0.0 114.683 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -70.94 -44.22 66.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD13 HG21 ' A' ' 74' ' ' THR . 95.7 mt -68.47 -38.89 81.48 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.649 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -74.08 -32.13 63.13 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.889 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.91 -55.25 4.05 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 66.3 t -64.51 -45.21 96.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.74 HD11 HD12 ' A' ' 49' ' ' LEU . 88.6 mt -72.75 -19.18 61.42 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.926 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.649 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 42.9 t0 -60.31 -36.12 77.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.0 m -86.11 5.76 32.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.183 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.46 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.4 t -65.36 142.19 58.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.399 0.619 . . . . 0.0 111.926 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -130.88 40.32 3.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.582 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 96.12 -15.46 62.92 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.023 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.18 97.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.931 0.365 . . . . 0.0 111.749 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.535 ' HG ' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -108.47 -22.99 12.06 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.173 0.511 . . . . 0.0 109.997 179.142 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.46 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.95 107.61 0.15 Allowed Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.25 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.2 p90 -52.71 -48.47 66.59 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.312 0.556 . . . . 0.0 110.31 178.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -84.17 0.01 50.35 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.599 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.44 -41.76 95.45 Favored Glycine 0 C--N 1.329 0.164 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.45 -177.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.74 HD12 HD11 ' A' ' 37' ' ' LEU . 92.7 mt -84.05 -43.02 15.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.04 0.42 . . . . 0.0 111.186 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.96 94.6 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.591 0.959 . . . . 0.0 113.591 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -60.58 -43.7 97.05 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.147 0.279 . . . . 0.0 111.302 -178.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 . . . . . 0 N--CA 1.461 0.11 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.588 179.185 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.5 t70 . . . . . 0 N--CA 1.462 0.174 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -66.65 -26.7 67.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.917 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.533 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.53 -41.87 86.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.342 0.592 . . . . 0.0 109.914 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.492 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.38 -34.79 75.08 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.42 178.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.12 -47.7 83.44 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.596 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 61.8 mm-40 -89.36 -3.38 58.48 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -55.77 -33.59 34.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.294 0.497 . . . . 0.0 111.268 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.61 -4.61 57.74 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.899 0.38 . . . . 0.0 110.721 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -108.53 22.82 15.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.196 -178.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.636 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.74 16.04 18.65 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.169 -1.015 . . . . 0.0 114.734 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.636 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 97.83 143.73 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.491 1.116 . . . . 0.0 111.975 177.26 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.2 t -132.09 -27.81 1.79 Allowed 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.495 178.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.34 2.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 119.962 -1.113 . . . . 0.0 112.204 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 33' ' ' LEU . 21.8 m -87.24 -35.96 18.21 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.774 -0.251 . . . . 0.0 111.535 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -60.57 -46.73 89.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.874 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.52 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.4 tt0 -62.08 -42.81 99.59 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.476 0.179 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 tp -61.57 -46.42 89.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.463 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.642 HD22 ' HG3' ' A' ' 84' ' ' LYS . 98.3 mt -67.33 -39.54 85.83 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.486 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -80.26 -5.54 56.39 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.5 m -59.07 -40.01 83.87 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -86.4 -90.61 0.11 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.18 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.33 -87.28 0.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 109.717 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -110.47 -56.91 2.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.917 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.4 ttpp -132.5 -43.36 0.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.206 176.446 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 48.51 34.32 4.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.891 0.876 . . . . 0.0 111.883 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.489 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.22 169.3 18.03 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.2 p -125.28 158.62 33.69 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.717 179.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.87 -40.06 81.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.792 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.5 -40.17 98.32 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.733 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.27 -40.79 96.7 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.634 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.259 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.16 -40.1 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.113 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -61.7 -41.35 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.906 0.384 . . . . 0.0 110.482 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.2 t -69.32 -41.17 80.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.282 0.563 . . . . 0.0 110.022 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -59.06 -36.85 75.74 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.704 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.84 -39.35 94.12 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.353 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -61.9 -47.37 85.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.65 0.262 . . . . 0.0 110.657 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.2 mmm -71.21 -36.22 71.79 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.36 33.06 36.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.331 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.535 ' NE2' ' HG ' ' A' ' 44' ' ' LEU . 32.9 t-80 -66.8 108.25 2.46 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.524 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -63.75 -44.74 92.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -64.39 -41.4 96.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.006 0.432 . . . . 0.0 111.044 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.518 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.91 -40.3 92.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.806 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.6 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -62.72 -45.1 99.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.99 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -65.96 -40.54 91.38 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -83.03 -22.37 33.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.6 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.9 tp -66.41 -20.79 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.753 0.311 . . . . 0.0 111.161 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.3 p -70.5 -10.25 58.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.934 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -69.92 -26.24 64.05 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.865 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.449 ' CE1' HD13 ' A' ' 25' ' ' LEU . 82.1 t80 . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.266 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 . . . . . 0 C--O 1.221 -0.414 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -72.1 121.0 18.51 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.19 160.35 11.61 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.0 tp -65.85 -51.03 62.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -76.09 -36.73 58.82 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.457 0.646 . . . . 0.0 111.242 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.88 70.9 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.836 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -45.43 154.43 0.51 Allowed Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 123.869 0.731 . . . . 0.0 111.848 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -38.04 163.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 125.12 3.88 . . . . 0.0 115.075 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -48.76 -9.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.415 3.41 . . . . 0.0 115.177 -178.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.777 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -53.86 -35.29 61.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.784 0.265 . . . . 0.0 110.5 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.83 HD23 ' HD2' ' A' ' 84' ' ' LYS . 3.0 tp -108.03 -77.3 0.6 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.197 0.444 . . . . 0.0 112.197 178.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -53.98 51.54 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.68 -51.75 57.12 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.63 -0.795 . . . . 0.0 115.045 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.5 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 35.8 tp10 -71.3 -43.06 67.82 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.44 -39.32 85.38 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.631 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.4 p -71.46 -29.2 64.58 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.474 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.55 -55.8 3.82 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.406 HG21 ' HG2' ' A' ' 102' ' ' ARG . 54.8 t -64.14 -44.93 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.527 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 88.6 mt -77.56 -16.8 58.42 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 122.068 -0.395 . . . . 0.0 111.846 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.631 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 32.5 t70 -59.34 -39.59 83.65 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.134 0.493 . . . . 0.0 110.556 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -93.27 11.42 28.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.003 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 t -67.86 144.68 55.19 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.015 0.436 . . . . 0.0 111.199 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -136.59 54.89 1.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.92 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.07 -12.94 68.85 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.035 -0.602 . . . . 0.0 114.095 178.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.99 98.75 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.564 0.682 . . . . 0.0 110.894 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -125.38 -30.63 3.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.569 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.5 117.3 0.74 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.237 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.451 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 27.6 p90 -56.24 -42.81 77.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 117.043 0.421 . . . . 0.0 110.743 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.604 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.27 -0.35 52.01 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.671 178.193 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.87 -45.65 94.72 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.548 -0.834 . . . . 0.0 113.235 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.5 mt -72.21 -43.32 64.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.887 0.343 . . . . 0.0 111.262 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.772 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.4 -41.64 93.45 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -61.71 -43.79 98.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.305 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 . . . . . 0 C--N 1.332 -0.192 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.612 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 120.927 0.394 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -76.29 -24.07 54.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.719 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.604 HD13 ' HB3' ' A' ' 47' ' ' ARG . 79.0 mt -59.85 -43.6 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.124 0.488 . . . . 0.0 110.294 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -67.39 -36.24 80.9 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.931 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.85 -49.06 76.38 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.9 mt-10 -90.08 -4.17 57.51 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.521 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.2 p -56.44 -33.71 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.364 0.529 . . . . 0.0 111.226 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.38 -4.25 58.12 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 110.803 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -106.97 22.13 16.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.026 -178.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.665 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.41 20.94 9.7 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.275 -0.964 . . . . 0.0 114.124 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.665 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.2 tppp? 95.72 147.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.447 1.099 . . . . 0.0 112.082 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.5 t -138.29 -30.91 0.77 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.54 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -52.88 -66.95 2.36 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.279 -0.963 . . . . 0.0 112.708 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.3 m -87.8 -34.45 18.28 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 122.441 -0.447 . . . . 0.0 111.113 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -60.9 -48.37 82.12 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.812 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.0 tt0 -63.15 -41.19 99.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.641 0.258 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.772 HD22 ' HA ' ' A' ' 50' ' ' ALA . 62.2 tp -60.89 -47.23 87.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.6 mt -70.34 -38.51 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.113 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -76.64 -6.62 52.83 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 64.6 m -58.87 -40.29 83.92 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -86.5 -90.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.786 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.26 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.41 -55.98 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.83 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.2 ttpm? -132.31 -43.75 0.94 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.1 t30 47.76 36.02 5.3 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.752 0.821 . . . . 0.0 111.269 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.0 170.85 15.23 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.802 -178.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.5 p -117.99 155.38 30.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.037 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.14 -39.3 78.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.873 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.8 -39.02 97.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.027 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -62.26 -46.63 87.95 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.604 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -75.98 -23.88 55.35 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.178 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.21 -39.46 82.72 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.027 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 53.3 mt-30 -61.22 -42.16 98.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.04 0.448 . . . . 0.0 110.47 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 99.7 t -71.75 -40.15 69.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.391 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 86.2 mt -61.64 -41.08 97.01 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.209 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 16.6 pt20 -68.67 -28.14 66.61 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.41 -48.83 73.89 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 88.7 mmm -71.76 -36.72 70.47 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.437 178.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.48 40.41 3.43 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.947 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -73.87 88.57 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.987 0.422 . . . . 0.0 111.578 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 19.4 mmt85 -62.76 -43.25 99.28 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HG2' HG21 ' A' ' 36' ' ' VAL . 7.3 tpm_? -63.22 -40.01 96.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.819 0.342 . . . . 0.0 111.106 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.78 -38.27 87.42 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.602 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.591 ' O ' HG22 ' A' ' 107' ' ' ILE . 94.6 mt -61.39 -44.29 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -65.08 -40.78 95.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.581 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.5 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -81.07 -22.39 39.26 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.502 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.777 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.5 tp -63.18 -20.97 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.863 0.363 . . . . 0.0 111.08 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.8 p -73.02 -13.18 61.17 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.621 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -74.33 -10.03 59.18 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.628 ' HE1' HD22 ' A' ' 25' ' ' LEU . 87.9 t80 . . . . . 0 CA--C 1.53 0.192 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.3 m80 . . . . . 0 C--O 1.22 -0.462 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.457 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.5 m -78.68 113.38 16.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.387 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' THR . 26.8 mt -154.8 170.61 21.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.76 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.3 tp -63.24 -50.46 70.11 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -92.01 -35.99 13.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.09 0.471 . . . . 0.0 111.583 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.65 70.78 0.88 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.1 mt -45.09 158.84 0.28 Allowed Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.923 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' HG23 ' A' ' 20' ' ' THR . 2.4 Cg_endo -39.96 165.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 124.67 3.58 . . . . 0.0 114.546 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -48.88 -8.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.038 3.159 . . . . 0.0 114.919 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.49 -36.82 67.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 117.867 0.303 . . . . 0.0 110.273 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.963 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.1 tp -107.8 -78.27 0.59 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tt -60.32 -48.54 81.29 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.96 -51.09 59.47 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.331 -0.938 . . . . 0.0 114.436 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.05 -43.3 68.1 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.3 mt -67.36 -37.95 84.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -75.0 -31.97 61.54 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.652 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.51 -58.46 2.66 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.32 -44.8 99.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.467 HD21 ' CD2' ' A' ' 100' ' ' HIS . 76.1 mt -71.91 -19.55 61.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.528 -178.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 28.2 t0 -61.7 -38.28 87.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.123 0.487 . . . . 0.0 110.591 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.3 p -87.35 1.68 52.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.012 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.9 t -66.89 142.55 57.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.267 0.556 . . . . 0.0 111.634 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -131.51 50.07 2.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.468 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.8 -12.78 68.78 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.821 -0.627 . . . . 0.0 113.65 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.44 98.68 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.159 0.504 . . . . 0.0 111.097 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.1 mt -116.16 -29.41 6.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.51 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.81 107.9 0.55 Allowed Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.241 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.547 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 33.1 p90 -53.81 -44.99 70.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.988 0.394 . . . . 0.0 110.671 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.625 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -85.31 -0.51 54.98 Favored 'General case' 0 C--O 1.219 -0.541 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 178.277 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.98 -47.36 91.1 Favored Glycine 0 C--N 1.329 0.166 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.076 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HG21 ' A' ' 74' ' ' THR . 88.8 mt -72.55 -42.13 65.0 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.858 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.31 -42.54 99.03 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.12 -42.04 99.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.092 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.231 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.98 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.461 0.109 0 CA-C-O 121.153 0.502 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -80.16 -23.85 40.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.283 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.625 HD13 ' HB3' ' A' ' 47' ' ' ARG . 80.3 mt -57.96 -44.57 87.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-O 120.616 0.246 . . . . 0.0 111.019 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.527 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -67.36 -37.34 83.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.132 0.491 . . . . 0.0 110.838 178.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.42 -50.27 68.23 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.593 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 52.5 mm-40 -89.75 -5.34 57.07 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.527 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.5 p -57.93 -32.79 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-N 118.266 0.485 . . . . 0.0 111.065 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.8 -4.93 58.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.866 0.365 . . . . 0.0 110.516 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -104.78 21.41 16.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.781 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.8 11.18 33.28 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-O 118.407 -1.218 . . . . 0.0 114.976 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.5 OUTLIER 112.17 141.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.047 1.339 . . . . 0.0 111.624 177.34 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.8 t -128.54 -35.7 1.92 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.797 178.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -49.43 -62.11 5.01 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.847 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.514 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -89.55 -43.06 11.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.531 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 75.8 ttt180 -61.77 -47.63 84.29 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' A' ' 72' ' ' SER . 50.3 tp10 -61.88 -43.67 98.38 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.3 -0.16 . . . . 0.0 111.308 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.78 -44.12 94.32 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.599 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.3 mt -64.62 -39.67 94.13 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.928 0.394 . . . . 0.0 111.057 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -82.13 -6.36 59.13 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.7 m -59.77 -39.48 85.01 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -85.79 -90.67 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.39 -86.33 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.346 0.593 . . . . 0.0 110.018 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -113.25 -57.07 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.963 ' HD2' HD23 ' A' ' 29' ' ' LEU . 14.9 ttpp -132.12 -42.59 0.98 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.6 t30 49.1 33.62 5.01 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.652 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.519 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.65 167.8 21.28 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.5 p -127.23 158.86 36.03 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.67 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.19 -41.95 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.373 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -40.21 98.6 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.72 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.24 -45.62 87.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.771 0.32 . . . . 0.0 111.762 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.617 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.1 -24.69 55.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.63 -179.653 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' A' ' 95' ' ' LEU . 61.7 tp -59.15 -41.36 88.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.349 -179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.39 -41.59 98.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.138 0.495 . . . . 0.0 110.427 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.405 HG12 ' CD2' ' A' ' 49' ' ' LEU . 85.5 t -70.42 -39.86 76.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.416 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 90.6 mt -61.13 -40.26 93.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.608 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.93 -40.34 96.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.942 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.16 -48.03 81.88 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.38 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -71.11 -37.64 72.36 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.8 40.07 2.99 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.206 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.467 ' CD2' HD21 ' A' ' 37' ' ' LEU . 37.4 m80 -78.32 83.41 4.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -63.31 -41.46 98.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.144 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.3 tpp180 -63.53 -40.92 98.29 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 110.755 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.56 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.11 -39.23 89.2 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.484 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.596 ' O ' HG22 ' A' ' 107' ' ' ILE . 43.1 mm -62.58 -43.63 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.402 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -61.1 -48.2 82.76 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.788 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 mp -80.39 -21.26 42.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -62.53 -21.23 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-O 120.871 0.367 . . . . 0.0 111.082 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.1 m -62.78 -14.46 45.38 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.772 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.65 -26.26 64.31 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.551 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.276 179.319 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 41.7 m80 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 120.4 0.143 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.6 m -69.13 119.73 13.87 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.62 176.52 7.19 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.454 178.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.94 -58.03 3.36 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -72.66 -35.69 67.77 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.536 0.684 . . . . 0.0 110.813 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -112.25 70.56 0.72 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.849 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.479 HD22 ' HE1' ' A' ' 110' ' ' TYR . 98.5 mt -48.09 158.03 0.6 Allowed Pre-proline 0 CA--C 1.538 0.486 0 O-C-N 123.802 0.689 . . . . 0.0 111.589 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -38.77 165.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 124.987 3.792 . . . . 0.0 114.622 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -50.29 -9.34 0.17 Allowed 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 123.874 3.049 . . . . 0.0 114.812 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.19 -36.15 68.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.575 0.171 . . . . 0.0 110.546 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.937 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.4 tp -108.25 -78.93 0.58 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.17 -0.612 . . . . 0.0 112.562 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.34 -48.6 80.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.8 -52.35 53.5 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.525 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -72.37 -43.4 64.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 74' ' ' THR . 96.0 mt -67.5 -38.55 84.49 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -77.09 -33.0 57.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.101 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.57 -56.8 3.33 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.456 HG11 ' HG2' ' A' ' 102' ' ' ARG . 63.1 t -64.25 -45.07 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -177.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.628 HD13 HD11 ' A' ' 49' ' ' LEU . 53.0 mt -73.45 -17.62 61.22 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.152 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.6 t70 -59.41 -37.09 77.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 0.0 110.671 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.6 p -84.85 4.58 32.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.405 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 53.9 t -61.91 141.33 58.06 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.329 0.585 . . . . 0.0 112.005 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -132.36 45.94 2.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.89 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.86 -12.01 70.03 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.282 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.67 98.67 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.451 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.14 -23.49 8.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.018 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.73 109.86 0.25 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.957 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -53.06 -47.89 68.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.168 0.484 . . . . 0.0 110.532 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.34 2.3 36.94 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.02 -37.41 71.07 Favored Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.03 -177.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.628 HD11 HD13 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -82.19 -45.22 15.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.65 0.262 . . . . 0.0 110.832 179.503 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -61.84 -38.07 86.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.717 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.78 -43.4 94.39 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.157 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.379 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.187 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.041 0.448 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -74.39 -25.99 59.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.661 179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.526 HG21 ' HB3' ' A' ' 47' ' ' ARG . 83.1 mt -59.81 -43.71 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 109.975 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.8 mt-10 -67.85 -36.15 79.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.135 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.81 -49.07 76.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.99 -4.04 57.66 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -56.67 -33.9 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 118.239 0.472 . . . . 0.0 111.12 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.54 -4.24 57.98 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.847 0.356 . . . . 0.0 110.733 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -106.15 21.99 16.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.015 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.568 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.29 21.74 9.18 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.269 -0.967 . . . . 0.0 114.281 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 94.37 141.83 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.36 1.064 . . . . 0.0 112.175 177.342 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.553 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.3 t -132.31 -29.9 1.56 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.078 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.582 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.58 -54.15 40.15 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 119.865 -1.159 . . . . 0.0 112.269 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.658 HG21 ' HB3' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -91.5 -43.4 9.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.149 0.499 . . . . 0.0 111.872 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.534 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.4 ttt180 -60.13 -47.58 85.33 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.548 -177.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.7 tt0 -62.59 -41.13 98.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.754 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.658 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.19 -46.59 89.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.686 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.573 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.5 mt -71.61 -38.95 70.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.148 0.499 . . . . 0.0 111.014 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -75.32 -6.26 48.97 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -58.24 -40.35 81.5 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -86.77 -89.96 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.792 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -112.36 -55.79 2.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.937 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.74 -44.58 0.89 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.604 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.3 t30 47.66 35.87 4.94 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.941 178.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 167.9 21.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.8 p -117.51 157.58 26.04 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.396 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.42 -39.44 79.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.431 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.47 99.27 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 120.902 -0.665 . . . . 0.0 112.981 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.04 -40.84 97.21 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.624 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.79 -24.34 36.0 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.128 -179.715 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.66 -41.94 91.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.14 -41.33 98.15 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.445 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -66.73 -41.85 88.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.216 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 93.2 mt -61.62 -40.88 96.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.844 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -65.03 -39.59 93.57 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.527 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -61.81 -48.83 78.84 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.44 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 15.3 tpt -72.53 -39.82 67.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.8 40.35 2.02 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.987 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' HIS . . . . . 0.475 ' O ' HG12 ' A' ' 104' ' ' ILE . 77.4 m80 -78.38 87.68 4.4 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.718 0.294 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.64 -42.85 99.83 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ARG . . . . . 0.456 ' HG2' HG11 ' A' ' 36' ' ' VAL . 25.4 tpp180 -63.45 -41.08 98.64 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.125 0.488 . . . . 0.0 110.913 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.415 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.09 -38.12 85.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.646 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 40.3 mm -61.29 -44.19 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.674 179.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -64.7 -41.21 96.17 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.621 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -79.35 -23.04 43.65 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.47 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.2 tp -63.87 -21.14 28.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.92 0.391 . . . . 0.0 111.425 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -75.48 -9.46 58.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.75 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -89.21 5.05 46.54 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.479 ' HE1' HD22 ' A' ' 25' ' ' LEU . 60.2 t80 . . . . . 0 N--CA 1.466 0.362 0 CA-C-O 120.63 0.252 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.51 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 79.7 m80 . . . . . 0 C--O 1.223 -0.293 0 N-CA-C 111.69 0.255 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.591 HG23 ' HD3' ' A' ' 26' ' ' PRO . 77.7 m -77.74 120.07 22.13 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.59 170.51 21.33 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.029 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.6 -50.4 69.56 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -91.53 -35.0 14.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.363 0.602 . . . . 0.0 111.319 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.57 71.58 1.09 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.879 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.9 mt -44.7 156.95 0.33 Allowed Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.935 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.591 ' HD3' HG23 ' A' ' 20' ' ' THR . 4.1 Cg_exo -39.33 164.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 124.999 3.799 . . . . 0.0 114.488 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.51 ' HD3' ' HB2' ' A' ' 19' ' ' HIS . 9.6 Cg_endo -54.65 -7.72 0.98 Allowed 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.643 2.895 . . . . 0.0 113.973 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.43 -35.53 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.734 HD23 ' HD3' ' A' ' 84' ' ' LYS . 2.9 tp -105.7 -78.07 0.58 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.044 178.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.431 ' H ' ' HE3' ' A' ' 84' ' ' LYS . 61.7 tp -63.08 -46.04 89.31 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . 0.461 ' H ' ' HA ' ' A' ' 27' ' ' PRO . . . -60.01 -54.32 38.39 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.633 -0.794 . . . . 0.0 114.797 -177.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.7 tm-20 -73.2 -42.81 62.25 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 95.9 mt -67.6 -37.89 83.2 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 13.7 p -78.98 -32.48 45.27 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.883 -179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.31 -55.62 3.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.93 -44.58 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 80.9 mt -72.62 -19.27 61.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.249 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.2 t0 -60.49 -36.81 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.88 0.371 . . . . 0.0 110.829 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.1 m -86.01 5.14 34.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.108 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 52.0 t -65.33 141.94 58.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.291 0.567 . . . . 0.0 111.629 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -130.0 43.72 3.08 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.891 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.06 -12.5 69.07 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.402 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.3 97.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.037 0.418 . . . . 0.0 111.4 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.75 -23.38 10.65 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.649 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.41 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 78.41 109.9 0.19 Allowed Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.738 -178.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -52.73 -48.61 66.58 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 117.315 0.558 . . . . 0.0 110.674 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -83.74 1.28 43.49 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.576 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.67 -43.18 94.5 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.086 -178.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.2 mt -80.41 -41.58 24.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.029 0.415 . . . . 0.0 111.088 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.536 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -63.64 -41.68 98.21 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -60.18 -46.2 90.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.303 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 . . . . . 0 N--CA 1.463 0.194 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.943 179.443 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.608 0.242 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.419 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 25.9 p80 -78.5 -20.08 51.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.446 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.535 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -62.23 -42.22 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.461 0.648 . . . . 0.0 110.068 178.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.568 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.0 mm-40 -69.54 -33.4 72.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.756 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.3 mttt -62.86 -48.3 79.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.584 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 57.3 mm-40 -89.81 -4.33 57.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.668 -0.645 . . . . 0.0 112.739 -178.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.3 p -57.38 -33.3 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.161 0.437 . . . . 0.0 111.173 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.27 -4.63 58.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.939 0.4 . . . . 0.0 110.571 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -107.13 22.45 15.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.059 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.65 13.4 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.257 -0.973 . . . . 0.0 114.595 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 102.21 144.67 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.858 1.263 . . . . 0.0 111.916 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.9 t -130.7 -31.61 1.75 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.195 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.502 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.21 -63.35 5.25 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.841 -1.171 . . . . 0.0 111.546 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.449 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -89.08 -39.91 13.31 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 59.1 ttt85 -62.37 -48.7 78.59 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.1 tp10 -63.43 -39.71 95.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.5 tp -61.05 -45.98 92.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.28 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 83.9 mt -69.51 -39.32 77.64 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.945 0.402 . . . . 0.0 110.979 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -77.01 -5.78 50.06 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.8 m -58.53 -40.15 82.15 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -86.42 -89.66 0.11 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.735 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.7 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -114.37 -55.01 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.734 ' HD3' HD23 ' A' ' 29' ' ' LEU . 1.2 ttmp? -132.05 -44.66 0.95 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 175.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 46.03 36.88 3.3 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.918 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 161.91 36.1 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.0 p -115.33 155.2 27.77 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.509 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.4 mp -60.56 -38.52 78.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.12 -179.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.517 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.47 -39.83 97.84 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.581 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.32 -45.3 91.95 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.636 0.255 . . . . 0.0 111.644 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -72.51 -26.0 61.61 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.832 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.746 HD21 HG12 ' A' ' 107' ' ' ILE . 53.6 mt -59.54 -38.22 80.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -61.79 -42.17 98.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.037 0.446 . . . . 0.0 109.998 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 91.1 t -70.72 -41.22 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.352 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.5 mp -59.01 -38.7 79.84 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.612 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -62.51 -40.24 96.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.867 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.53 -41.99 92.47 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.4 tpt -70.99 -38.73 72.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.419 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.0 30.19 35.7 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.177 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -79.36 107.43 12.11 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.044 0.449 . . . . 0.0 110.649 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.95 -41.45 95.48 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -61.33 -40.52 94.53 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.234 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.435 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.99 -39.74 90.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.5 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.594 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -63.12 -43.89 99.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.014 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -64.48 -41.42 96.5 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.523 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -80.87 -22.04 40.18 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.348 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.746 HG12 HD21 ' A' ' 92' ' ' LEU . 1.8 tp -62.04 -20.36 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 70.3 p -72.07 -11.26 60.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.639 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -83.49 15.98 2.82 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.887 0.375 . . . . 0.0 111.471 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' TYR . . . . . 0.508 ' CD1' HD13 ' A' ' 88' ' ' ILE . 63.4 t80 . . . . . 0 C--N 1.331 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 110.814 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.99 0.424 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -73.37 137.9 44.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.785 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 58.56 33.24 22.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.758 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.1 -177.81 49.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.403 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.5 m -117.57 139.62 50.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.733 0.301 . . . . 0.0 110.7 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.404 ' HG3' ' OE1' ' A' ' 69' ' ' GLN . 22.8 ptp -157.39 163.98 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.439 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -128.12 144.9 51.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.35 . . . . 0.0 111.593 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 152.08 54.79 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.033 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.3 114.69 28.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.539 0.209 . . . . 0.0 111.387 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 30.1 p -149.42 162.27 40.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.696 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 177.52 179.89 47.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 121.108 -0.567 . . . . 0.0 111.801 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.08 145.41 28.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.968 0.384 . . . . 0.0 111.394 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 ttp180 -159.12 146.66 17.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -175.13 -175.87 42.94 Favored Glycine 0 N--CA 1.454 -0.137 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.724 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.89 93.21 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 121.023 0.44 . . . . 0.0 111.113 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.66 139.89 30.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -84.59 109.16 17.76 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.202 0.525 . . . . 0.0 111.467 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.86 -7.92 50.91 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.723 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -103.82 21.84 15.57 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.228 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.491 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.3 m -75.02 113.5 12.42 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 20' ' ' THR . 20.5 mt -159.81 162.14 34.7 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.64 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.2 tp -63.87 -50.04 70.39 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -81.62 -35.77 29.69 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.291 0.567 . . . . 0.0 111.792 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -112.56 71.01 0.73 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.679 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -44.68 156.92 0.33 Allowed Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 124.009 0.818 . . . . 0.0 111.955 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -39.03 165.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 125.09 3.86 . . . . 0.0 114.849 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -50.06 -8.95 0.14 Allowed 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 124.061 3.174 . . . . 0.0 114.906 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.548 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.92 -36.04 67.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.68 0.218 . . . . 0.0 110.673 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.7 tp -107.82 -78.65 0.58 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.529 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -61.87 -49.1 77.61 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.27 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.59 -51.6 58.11 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 120.405 -0.902 . . . . 0.0 114.535 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.444 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.4 tm-20 -72.67 -43.77 62.68 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.35 -38.94 88.77 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.9 p -75.21 -31.95 61.05 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.032 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.27 -55.95 3.77 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.4 t -64.47 -45.21 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.03 -18.59 61.94 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.06 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 16.9 t70 -59.96 -38.07 81.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.987 0.422 . . . . 0.0 110.772 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -83.3 3.02 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.444 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 48.3 t -62.37 141.53 58.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.402 0.62 . . . . 0.0 112.186 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -133.33 46.37 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.642 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.56 -12.86 68.25 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.462 -0.79 . . . . 0.0 113.177 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.71 98.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.964 0.382 . . . . 0.0 111.549 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -115.29 -25.2 8.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.174 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 80.14 107.58 0.27 Allowed Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.002 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -53.32 -46.0 69.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 117.244 0.522 . . . . 0.0 111.078 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.4 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.5 ptt180 -82.97 1.69 38.54 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.872 178.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.32 -44.13 93.53 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.323 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -73.55 -43.77 59.1 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.182 0.491 . . . . 0.0 111.211 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.78 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.67 -39.51 93.81 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.62 -42.62 97.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.795 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -42.67 99.62 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.473 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 1.005 HD23 HD11 ' A' ' 77' ' ' LEU . 51.5 tp -68.39 -39.95 81.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.2 m 59.36 52.09 6.2 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.139 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -63.83 -37.96 89.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.801 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -156.41 146.67 21.4 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.728 0.299 . . . . 0.0 110.641 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -70.56 -31.2 68.15 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.43 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.7 mt -88.78 0.5 56.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.548 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.409 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.0 t70 -61.3 -38.56 87.25 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.654 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.832 ' HA ' HD12 ' A' ' 63' ' ' ILE . 28.1 m -60.52 -27.47 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.37 -45.51 90.8 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.089 0.471 . . . . 0.0 110.698 179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.47 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -76.13 -21.54 56.49 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.507 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.832 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.4 mt -59.47 -42.22 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.093 0.473 . . . . 0.0 110.632 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.456 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -66.51 -35.17 79.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.97 0.414 . . . . 0.0 110.946 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.8 mttt -63.02 -49.57 74.12 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -177.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 7.5 mt-10 -89.74 -2.95 58.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.5 p -54.51 -32.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 118.423 0.556 . . . . 0.0 111.432 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.12 -4.73 58.21 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.793 0.33 . . . . 0.0 111.007 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.404 ' OE1' ' HG3' ' A' ' 6' ' ' MET . 28.8 mm100 -106.48 22.47 15.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.105 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.629 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.92 19.22 12.15 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.101 -1.047 . . . . 0.0 114.131 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 96.5 142.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.337 1.055 . . . . 0.0 111.862 177.594 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.5 t -131.0 -26.42 2.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.388 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.58 -64.58 4.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.095 -1.05 . . . . 0.0 111.892 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.7 m -88.32 -38.48 15.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 111.694 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.3 ttt-85 -60.37 -47.75 84.71 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -177.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.563 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.5 tt0 -63.21 -40.35 97.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.758 0.313 . . . . 0.0 110.866 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 1.005 HD11 HD23 ' A' ' 53' ' ' LEU . 59.0 tp -61.1 -46.45 90.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.65 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.495 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.2 mt -70.5 -38.58 74.34 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -75.7 -6.73 51.94 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.685 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.8 m -58.65 -40.13 82.57 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -86.26 -89.57 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.788 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.59 -86.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -114.13 -54.83 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.9 ttpp -132.66 -44.2 0.9 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.437 175.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.7 t30 47.76 35.78 5.04 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.753 0.821 . . . . 0.0 111.815 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.25 171.08 14.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.921 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -121.21 157.96 29.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.73 -39.09 78.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.69 -39.72 98.28 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.774 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.35 -45.52 90.82 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.606 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.54 -23.98 45.91 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.393 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.6 tp -59.36 -40.64 87.1 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.673 0.273 . . . . 0.0 110.724 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -62.24 -41.53 98.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.299 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -69.56 -41.11 80.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.0 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.2 mp -59.84 -41.12 90.68 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.826 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.61 -40.51 97.09 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.073 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.78 -46.18 89.21 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.823 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.3 mmm -70.09 -37.34 75.38 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.775 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.48 38.51 5.28 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.383 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.476 ' NE2' ' HB3' ' A' ' 44' ' ' LEU . 39.4 m170 -79.98 91.71 5.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.928 0.394 . . . . 0.0 110.631 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -62.9 -42.08 99.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.9 tpt85 -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 110.647 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.24 -38.91 88.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.731 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 45.1 mm -62.78 -39.56 85.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.863 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -60.25 -48.0 83.61 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.222 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.444 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -80.71 -22.04 40.68 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -178.882 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 3.1 tp -60.66 -20.66 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 120.871 0.367 . . . . 0.0 111.424 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -71.94 -12.22 61.15 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.609 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.25 -27.18 65.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.189 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -60.34 -47.63 85.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.891 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 102.47 154.95 25.4 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.924 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.81 7.0 21.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.679 0.276 . . . . 0.0 111.51 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.8 p -138.56 142.87 33.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.8 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mp 62.1 29.3 17.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.695 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 79.2 p -81.47 151.23 68.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.179 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.01 62.46 8.49 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.777 2.318 . . . . 0.0 112.598 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.9 m -127.47 147.13 50.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -127.29 146.24 50.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.472 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -63.14 -39.67 95.34 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.518 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 45.4 m 61.5 35.8 17.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.781 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -111.12 27.36 9.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.096 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -116.29 142.38 46.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.687 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -125.41 146.86 49.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.572 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.134 -1.37 . . . . 0.0 112.23 179.986 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.032 0.444 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -104.19 119.28 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -102.72 1.89 35.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.188 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 76.17 -159.13 50.15 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.403 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.4 m 57.73 42.1 24.14 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.699 0.4 . . . . 0.0 111.888 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 25.7 mmt -104.45 139.03 39.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.567 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.56 154.68 41.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.042 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.2 -8.97 77.19 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.923 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -87.84 75.7 8.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 0.0 110.604 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 30.7 p -157.75 168.14 28.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 96.11 164.76 33.78 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.922 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.65 148.27 30.89 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -62.82 -45.51 92.29 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.427 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.35 168.14 20.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.408 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.86 -39.96 94.39 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.857 0.361 . . . . 0.0 111.931 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -108.65 147.11 32.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.7 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 p -81.59 109.85 16.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.126 0.489 . . . . 0.0 111.212 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.29 -8.49 50.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.988 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -104.49 22.27 15.26 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.804 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.6 m -71.24 116.07 11.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.654 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.41 162.44 17.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.312 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -64.84 -50.46 66.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.02 -35.81 23.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.412 0.625 . . . . 0.0 111.408 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -110.11 70.67 0.73 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.146 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.9 mt -46.35 156.18 0.51 Allowed Pre-proline 0 N--CA 1.467 0.405 0 O-C-N 124.067 0.854 . . . . 0.0 111.69 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -38.83 165.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 124.98 3.787 . . . . 0.0 114.698 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.91 -8.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.2 3.266 . . . . 0.0 115.204 -178.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.593 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.3 -36.64 66.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.975 0.352 . . . . 0.0 110.39 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.909 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.5 tp -106.65 -78.33 0.58 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.41 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.5 OUTLIER -60.5 -51.7 68.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.57 -51.26 60.13 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.639 -0.791 . . . . 0.0 114.826 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.498 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.3 tm-20 -70.88 -43.62 68.0 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.444 HD13 HG21 ' A' ' 74' ' ' THR . 95.4 mt -67.08 -38.8 86.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.3 p -72.19 -31.07 65.57 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.62 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.62 -55.49 3.96 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.53 -45.69 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -73.11 -19.16 61.2 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.377 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.7 t70 -60.11 -39.16 85.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.012 0.434 . . . . 0.0 111.098 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.9 m -90.22 9.12 29.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.971 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 t -68.02 143.82 55.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.205 0.526 . . . . 0.0 111.695 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.32 49.51 2.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.217 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.69 -12.57 69.21 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.561 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.71 98.73 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.16 0.505 . . . . 0.0 111.136 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.4 mt -119.44 -26.63 5.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.722 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.92 113.51 0.32 Allowed Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.894 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 9.6 p90 -53.29 -47.44 69.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.009 0.404 . . . . 0.0 110.473 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.9 ptt180 -84.29 1.11 46.39 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.917 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.69 -46.7 91.9 Favored Glycine 0 CA--C 1.517 0.199 0 C-N-CA 120.159 -1.02 . . . . 0.0 113.334 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.18 -42.61 59.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.017 0.408 . . . . 0.0 110.911 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.6 -40.43 96.91 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.37 -45.81 92.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.237 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -68.67 -40.5 80.11 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.842 0.353 . . . . 0.0 111.234 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.0 mt -67.65 -41.45 83.79 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.193 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -143.64 136.49 27.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.708 0.29 . . . . 0.0 110.66 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -112.91 118.82 35.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.865 0.364 . . . . 0.0 111.294 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.9 t -157.83 143.01 16.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.182 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -85.3 -15.32 43.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.477 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.48 -31.65 15.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.349 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.3 -38.38 90.95 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.306 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.781 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.9 m -62.66 -25.45 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.85 -45.87 90.58 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.313 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -74.69 -25.08 58.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.962 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.7 mt -59.88 -43.4 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 110.161 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.555 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -66.99 -36.01 81.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.69 -49.08 76.52 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -90.18 -3.78 57.66 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.6 p -56.05 -34.41 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.271 0.487 . . . . 0.0 111.321 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.2 -4.21 58.31 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 110.813 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -105.67 21.93 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.751 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.617 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.04 21.42 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.362 -0.923 . . . . 0.0 114.276 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 94.91 141.56 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.319 1.047 . . . . 0.0 112.159 177.376 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.536 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.8 t -131.56 -29.89 1.71 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.42 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -53.02 -66.98 2.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.356 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.444 HG21 HD13 ' A' ' 33' ' ' LEU . 24.9 m -87.38 -36.71 17.62 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 122.625 -0.338 . . . . 0.0 111.525 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -60.77 -47.16 87.58 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 81.7 tt0 -62.11 -42.4 99.19 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.17 -45.62 90.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.291 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.637 HD22 ' HG3' ' A' ' 84' ' ' LYS . 97.3 mt -67.6 -40.21 84.77 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.843 0.354 . . . . 0.0 111.285 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -81.5 -5.85 58.37 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.6 t -58.99 -41.35 87.44 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.9 m95 -85.4 -89.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.796 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.53 -87.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -114.47 -54.29 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.909 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.0 ttpp -132.3 -43.51 0.94 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.4 t30 48.25 34.19 4.31 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.791 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.479 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.51 170.83 15.2 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.789 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 63.2 p -126.45 159.13 34.21 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.375 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.568 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.7 mp -59.7 -40.03 81.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.407 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.425 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.0 -39.49 97.14 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.546 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -63.82 -44.23 93.85 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.665 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -73.85 -27.58 61.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.736 -179.532 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.6 mt -60.28 -32.83 71.56 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.542 0.21 . . . . 0.0 111.442 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -61.03 -42.52 98.63 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.479 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -86.3 -23.21 6.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.411 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.8 mp -61.9 -43.25 99.24 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.833 0.349 . . . . 0.0 110.255 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -65.72 -39.95 91.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.739 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -64.21 -43.84 93.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.03 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -71.75 -39.13 70.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.595 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.24 33.36 6.0 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.551 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -75.92 86.28 2.86 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.065 0.459 . . . . 0.0 111.35 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.84 -41.21 95.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.549 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.24 -39.86 94.82 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.487 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.549 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.71 -38.81 86.3 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.731 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.1 mt -61.47 -43.67 97.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.278 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -61.48 -47.66 84.67 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.245 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.498 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -77.88 -22.46 49.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -179.149 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.593 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.1 tp -63.32 -19.99 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.773 0.321 . . . . 0.0 111.478 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.2 p -67.84 -12.84 61.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.429 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -69.83 -27.45 64.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.52 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -70.61 129.39 39.05 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.91 139.89 17.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.494 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -84.36 -0.06 51.18 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.1 -44.28 98.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.02 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.4 mt -110.49 132.29 54.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.806 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.4 m -125.82 90.23 50.82 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.45 65.77 7.29 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.58 2.186 . . . . 0.0 112.895 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.3 p -63.99 -34.16 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 58.42 42.01 21.96 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.647 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -62.33 -39.41 92.97 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.3 m 60.64 -148.92 0.43 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.636 0.585 . . . . 0.0 111.381 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 58.65 33.91 23.43 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.419 0.449 . . . . 0.0 111.857 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -86.17 144.01 27.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.645 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 57.9 39.62 26.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.51 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.223 -1.32 . . . . 0.0 112.332 -179.979 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.659 0.266 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 60.66 40.55 16.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.815 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -113.15 148.57 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.874 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.26 174.15 36.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.811 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.422 ' HA ' ' OD1' ' A' ' 41' ' ' ASP . 52.4 m -103.83 123.6 47.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.931 0.366 . . . . 0.0 111.044 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 78.8 mtm -136.69 157.42 46.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.589 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.79 153.81 48.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.591 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -129.64 156.76 21.53 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.58 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.8 p-10 -119.51 19.53 12.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.734 0.302 . . . . 0.0 111.382 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.8 m -101.26 129.89 47.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.942 0.401 . . . . 0.0 111.393 -179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.31 -175.35 39.0 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.346 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -133.27 147.0 51.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.807 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 125.06 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.986 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.77 8.78 19.25 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.188 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -117.65 -66.53 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.994 0.397 . . . . 0.0 111.772 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.3 mt -108.8 144.02 37.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.3 p -90.01 110.01 21.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.906 0.384 . . . . 0.0 111.3 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.19 -11.27 38.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 0.0 111.086 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -108.8 21.54 17.1 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.776 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t -74.43 125.37 28.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -178.44 4.99 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.492 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.05 -58.23 3.26 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -73.92 -35.73 64.64 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.554 0.692 . . . . 0.0 110.513 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -109.91 70.28 0.72 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.732 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.611 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.6 mt -48.34 156.38 0.81 Allowed Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.987 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -34.93 163.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 125.086 3.857 . . . . 0.0 115.17 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.24 -8.72 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 124.277 3.318 . . . . 0.0 115.054 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.62 -35.56 63.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.605 0.184 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HB3' ' A' ' 91' ' ' LEU . 6.6 tp -108.64 -79.19 0.58 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.3 tp -62.01 -47.75 83.37 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.63 -51.3 59.56 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.651 -0.785 . . . . 0.0 114.632 -177.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -70.5 -43.52 69.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.71 -38.44 86.74 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.967 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.8 p -73.25 -31.82 64.34 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.797 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.34 -54.49 4.56 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -178.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 71.5 t -64.54 -43.99 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.8 mt -71.09 -18.25 62.55 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.419 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 5.7 t70 -59.58 -37.81 79.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 0.0 110.661 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.1 m -86.75 7.39 26.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.9 t -65.54 140.01 58.52 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.345 0.593 . . . . 0.0 111.746 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.422 ' OD1' ' HA ' ' A' ' 5' ' ' SER . 24.3 t0 -131.42 44.06 2.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.454 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.59 -10.91 72.21 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.392 -0.822 . . . . 0.0 113.017 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.19 97.71 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.905 0.352 . . . . 0.0 111.562 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -116.24 -22.19 8.98 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.53 113.72 0.25 Allowed Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.764 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -52.37 -49.2 64.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.284 0.542 . . . . 0.0 109.925 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.455 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.6 ptt180 -83.93 1.38 43.73 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.562 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.62 92.33 Favored Glycine 0 CA--C 1.516 0.129 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.437 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.409 HD22 HD12 ' A' ' 95' ' ' LEU . 89.3 mt -73.7 -43.32 59.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 0.0 111.223 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.517 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.53 -39.9 94.63 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -59.69 -45.05 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.383 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -65.48 -40.01 92.61 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.745 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.441 HD22 HD11 ' A' ' 77' ' ' LEU . 0.9 OUTLIER -70.09 -43.87 70.22 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.734 0.302 . . . . 0.0 110.968 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m -139.0 117.68 12.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 0.0 110.861 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.3 m -105.9 90.24 3.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.664 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.3 m -133.53 149.74 51.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.2 p90 -86.37 168.36 13.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.445 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp 73.25 -40.83 0.48 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.428 0.691 . . . . 0.0 111.768 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.42 -24.43 67.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.587 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.693 ' HA ' HD12 ' A' ' 63' ' ' ILE . 22.5 m -63.46 -21.87 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.904 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -64.3 -42.14 96.51 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 110.576 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -68.84 -26.36 65.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.023 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.693 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.9 mt -59.67 -38.99 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.183 0.516 . . . . 0.0 110.455 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.491 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.4 mm-40 -79.66 -21.24 45.01 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.106 -0.371 . . . . 0.0 111.193 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.17 -45.41 60.53 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.621 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.3 mt-10 -87.97 -4.72 58.78 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.8 p -58.56 -28.55 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.236 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -74.73 -14.75 60.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -95.66 9.06 41.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.917 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 71' ' ' LYS . . . 104.22 -7.2 47.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 118.33 -1.261 . . . . 0.0 114.866 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 2.0 tppt? 158.58 139.1 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.263 1.032 . . . . 0.0 112.088 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.654 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.0 t -134.27 -24.17 1.64 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.46 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.23 -67.43 2.22 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.97 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.3 m -88.62 -35.12 17.03 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.569 -0.371 . . . . 0.0 111.482 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.551 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 74.0 ttt180 -60.75 -46.35 90.78 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.731 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 72' ' ' SER . 80.7 tt0 -60.54 -44.27 96.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 110.52 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -62.54 -47.82 82.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.253 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.906 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.3 mt -65.16 -39.81 93.45 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.53 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -81.0 -5.75 57.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.8 m -59.34 -39.84 84.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 65.8 m95 -86.27 -89.97 0.11 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.278 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.82 -87.07 0.49 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.134 0.492 . . . . 0.0 110.053 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -112.62 -56.75 2.37 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.906 ' HG3' HD22 ' A' ' 78' ' ' LEU . 13.6 ttpp -131.95 -43.57 0.98 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.564 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.6 t30 49.73 28.93 2.89 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.975 -1.012 . . . . 0.0 112.91 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.611 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 37.8 mttp -135.51 134.17 39.22 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 44.5 p -83.82 161.19 21.01 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.61 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.06 -40.33 82.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.143 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.36 -40.21 98.66 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.49 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -63.46 -48.59 77.08 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.921 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -75.98 -24.11 55.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.862 -179.625 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.722 HD13 HD13 ' A' ' 107' ' ' ILE . 62.4 tp -58.82 -39.38 81.01 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.425 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.88 -41.16 95.43 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.868 0.366 . . . . 0.0 110.452 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.7 -40.71 84.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 121.224 0.535 . . . . 0.0 109.729 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -60.31 -39.92 88.72 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.613 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.39 -40.02 96.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.812 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -63.94 -41.67 97.55 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.731 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.0 tpt -70.05 -38.84 75.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.086 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.29 29.77 11.92 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.721 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -76.22 99.47 4.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.924 0.392 . . . . 0.0 111.06 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.58 -41.83 96.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.669 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -62.31 -41.39 98.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.125 0.488 . . . . 0.0 110.805 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.89 -39.88 90.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.701 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.561 ' O ' HG22 ' A' ' 107' ' ' ILE . 42.0 mm -62.66 -45.21 99.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -66.51 -40.76 89.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 106' ' ' LEU . 1.3 tp -83.89 -21.79 31.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.722 HD13 HD13 ' A' ' 92' ' ' LEU . 10.2 tt -65.79 -20.22 26.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.927 0.394 . . . . 0.0 111.321 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.0 p -70.05 -9.93 57.0 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.814 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.41 -17.62 63.02 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.611 ' HE1' HD22 ' A' ' 25' ' ' LEU . 89.7 t80 -60.29 -47.95 83.83 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.779 0.323 . . . . 0.0 110.352 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 63.64 -125.79 33.85 Favored Glycine 0 C--N 1.332 0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 113.659 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.03 145.78 55.88 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.022 0.439 . . . . 0.0 112.107 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.0 m -78.57 154.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.247 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.5 mt -109.23 133.16 53.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.855 0.359 . . . . 0.0 111.031 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 53.4 m -82.77 131.18 55.37 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.717 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.51 139.21 89.47 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.736 2.291 . . . . 0.0 112.549 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 81.2 p -70.17 -30.42 67.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.855 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.82 149.0 50.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.807 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -63.97 -39.74 94.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.368 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 57.8 m -133.16 149.41 52.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.186 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.39 152.3 47.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.424 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -142.02 157.92 44.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.366 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -124.85 145.62 49.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.577 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.505 -1.164 . . . . 0.0 112.157 -179.96 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 121.063 0.459 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -120.86 143.01 49.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.738 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.87 149.89 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.588 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.92 174.02 39.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.997 -0.62 . . . . 0.0 111.961 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.7 m -112.47 118.3 34.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.849 0.324 . . . . 0.0 110.94 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm -119.46 11.65 12.19 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.974 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 65.14 -163.77 0.25 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.623 0.577 . . . . 0.0 111.37 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.89 -174.71 47.26 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.139 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -97.63 173.18 7.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.867 0.365 . . . . 0.0 110.784 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -119.24 154.18 33.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.125 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -159.42 175.94 36.26 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.064 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.42 146.6 50.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.702 0.287 . . . . 0.0 111.09 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.6 ttp-105 -120.11 126.65 51.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.022 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.27 155.29 34.22 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.99 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.59 97.79 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.889 0.376 . . . . 0.0 111.373 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.8 mt -83.39 144.9 29.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.816 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.0 p -80.9 108.33 14.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.723 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.87 -10.02 38.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.384 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -106.4 21.51 17.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.073 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.9 t -81.64 113.58 19.75 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.7 mt -153.36 167.09 30.57 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.836 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.13 -50.19 71.42 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -81.8 -35.58 29.36 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.493 0.663 . . . . 0.0 111.348 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.42 71.85 0.76 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.009 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -44.53 155.45 0.37 Allowed Pre-proline 0 CA--C 1.538 0.515 0 O-C-N 123.978 0.798 . . . . 0.0 111.22 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -38.69 165.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 124.846 3.697 . . . . 0.0 114.794 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -49.05 -8.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 124.01 3.14 . . . . 0.0 114.99 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.778 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.76 -35.79 64.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.741 0.246 . . . . 0.0 110.657 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.38 -78.64 0.59 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.4 tp -61.39 -48.65 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -51.1 60.73 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.595 -0.812 . . . . 0.0 114.494 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -70.79 -43.0 69.59 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.9 -38.68 86.73 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.842 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.661 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -73.25 -30.52 63.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.656 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.81 -55.45 3.96 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.72 -45.64 96.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.883 HD11 HD12 ' A' ' 49' ' ' LEU . 88.7 mt -71.62 -21.01 61.9 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.12 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.8 t0 -61.55 -38.65 88.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.039 0.447 . . . . 0.0 110.503 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.4 p -85.2 1.54 47.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.107 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.6 t -64.22 141.33 58.81 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.297 0.57 . . . . 0.0 111.663 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.91 39.04 3.85 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.926 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.18 -16.73 57.89 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.06 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.06 99.34 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.971 0.415 . . . . 0.0 111.816 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.89 -21.56 12.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.183 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.435 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.11 107.05 0.12 Allowed Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.563 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.2 p90 -52.88 -50.81 63.12 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 117.313 0.557 . . . . 0.0 110.349 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.542 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.77 -0.04 52.37 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.095 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.42 95.57 Favored Glycine 0 C--O 1.23 -0.115 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.023 -177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 37' ' ' LEU . 94.0 mt -81.79 -42.4 19.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.735 0.303 . . . . 0.0 111.215 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.45 -41.73 96.37 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -61.48 -41.26 96.98 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.115 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -64.22 -40.0 95.15 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.76 0.314 . . . . 0.0 111.203 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.506 HD22 HD21 ' A' ' 77' ' ' LEU . 1.7 tt -70.07 -46.96 63.84 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.842 -179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 68.8 m -148.8 150.38 32.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.838 0.351 . . . . 0.0 111.511 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.492 ' OG ' ' HA3' ' A' ' 124' ' ' GLY . 80.0 p -136.75 141.49 43.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.53 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -151.13 161.79 42.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.172 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -74.1 134.64 42.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.615 0.245 . . . . 0.0 110.729 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp 63.15 14.83 8.03 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.08 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.57 -40.03 94.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.886 0.374 . . . . 0.0 111.523 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.737 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.1 m -64.93 -19.98 26.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -60.97 -46.95 88.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.637 0.256 . . . . 0.0 110.404 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -72.66 -29.5 63.49 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.216 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 60' ' ' VAL . 84.7 mt -60.23 -43.11 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.537 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.1 mm-40 -67.64 -35.93 79.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.238 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.2 -48.61 79.24 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -89.95 -3.47 58.01 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -55.85 -34.04 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 118.202 0.455 . . . . 0.0 111.432 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.22 -4.77 58.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.935 0.397 . . . . 0.0 110.853 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.48 21.81 16.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.818 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.13 21.22 9.65 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.311 -0.947 . . . . 0.0 114.22 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 94.18 141.77 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.281 1.032 . . . . 0.0 112.248 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.565 ' H ' ' HD3' ' A' ' 71' ' ' LYS . 4.1 t -129.99 -30.38 2.01 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.998 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.35 -66.07 3.05 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.022 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.456 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.02 -35.6 18.69 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.822 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.494 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.7 ttt180 -62.69 -47.22 84.6 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.552 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -62.34 -41.33 98.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.615 0.245 . . . . 0.0 111.152 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.506 HD21 HD22 ' A' ' 53' ' ' LEU . 65.9 tp -61.07 -47.22 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.979 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.46 HD22 ' HG3' ' A' ' 84' ' ' LYS . 84.2 mt -71.46 -39.4 70.98 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.069 0.462 . . . . 0.0 111.673 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -76.62 -7.26 54.9 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -58.43 -38.59 77.75 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -87.58 -90.57 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.676 -0.409 . . . . 0.0 110.928 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.44 -86.81 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -110.96 -56.89 2.31 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.62 -43.49 0.91 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.419 176.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.4 36.21 6.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.718 0.807 . . . . 0.0 111.788 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.99 171.05 14.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.485 -179.264 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.481 HG22 ' HG2' ' A' ' 116' ' ' PRO . 67.8 p -121.21 157.4 30.34 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.324 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.449 HG13 HD13 ' A' ' 29' ' ' LEU . 1.2 mp -60.5 -39.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.374 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.97 -39.45 98.08 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.862 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -63.23 -45.67 90.53 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.604 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.49 -24.6 50.1 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.658 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.509 HD13 HD13 ' A' ' 107' ' ' ILE . 61.8 tp -58.97 -41.74 88.24 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.176 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.94 -41.81 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.087 0.47 . . . . 0.0 110.471 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.475 HG21 HD12 ' A' ' 53' ' ' LEU . 74.0 t -68.3 -42.06 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.431 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.0 mp -60.28 -40.17 89.47 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.004 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.1 -39.21 93.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.495 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -62.61 -45.33 93.34 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.476 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 14.5 tpt -72.61 -39.41 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.257 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.37 39.55 3.44 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.472 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.407 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 13.3 t-160 -80.47 95.23 6.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.177 0.513 . . . . 0.0 110.546 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.89 -42.3 94.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -62.77 -39.38 94.0 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.855 0.36 . . . . 0.0 111.695 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.407 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -60.54 -38.7 85.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.279 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -60.93 -43.27 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.035 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -62.96 -42.08 99.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.03 -31.13 25.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.778 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.0 tt -62.3 -24.49 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.18 0.514 . . . . 0.0 110.47 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 85.1 m -64.88 -26.13 68.19 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.076 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -67.92 -20.44 65.09 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.574 ' HE1' HD22 ' A' ' 25' ' ' LEU . 81.0 t80 -60.02 -48.93 79.67 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 178.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 58.23 -131.4 52.03 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.395 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . 65.89 164.39 0.17 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.444 0.698 . . . . 0.0 112.448 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 17.3 m -116.74 -10.19 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.914 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.5 tp -131.87 130.71 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.181 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.6 p -129.42 151.3 77.67 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.481 ' HG2' HG22 ' A' ' 87' ' ' THR . 57.3 Cg_endo -70.81 158.61 55.11 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.638 2.225 . . . . 0.0 112.499 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 63.0 m -109.36 146.27 34.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.885 0.374 . . . . 0.0 110.929 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -126.28 162.01 26.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.61 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -68.89 149.17 49.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.152 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 87.5 p -70.89 160.58 32.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.485 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -146.48 162.02 39.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.389 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -105.06 126.67 52.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.547 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -79.21 147.84 32.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLY . . . . . 0.492 ' HA3' ' OG ' ' A' ' 55' ' ' SER . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.473 -1.182 . . . . 0.0 112.512 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.09 0.471 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -122.4 141.43 51.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.538 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.89 149.32 50.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.634 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.12 172.23 39.88 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.998 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 97.8 p -153.16 161.89 41.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.544 0.172 . . . . 0.0 110.699 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 95.6 mmm 61.34 -131.08 0.72 Allowed 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.738 0.649 . . . . 0.0 110.803 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.407 ' HB1' HG21 ' A' ' 67' ' ' VAL . . . 56.22 61.46 2.72 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.289 0.368 . . . . 0.0 111.552 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -168.98 -175.47 38.37 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.427 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -145.1 174.83 10.71 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -99.03 130.95 45.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.913 0.387 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.11 -174.62 28.96 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.138 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.89 149.24 31.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.799 0.299 . . . . 0.0 111.41 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.8 -161.57 0.85 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.824 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.89 65.19 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.221 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.66 -165.98 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.782 -0.246 . . . . 0.0 110.979 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.0 mt -67.8 152.47 45.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.05 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -66.65 107.35 2.09 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 121.214 0.53 . . . . 0.0 111.433 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.52 -8.25 45.01 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.286 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -102.63 20.57 16.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.264 -178.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -72.61 115.08 11.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.794 0.33 . . . . 0.0 111.886 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 24' ' ' ASP . 23.8 tp -152.85 163.24 40.12 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.94 -47.63 85.54 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -90.87 -35.83 14.54 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.425 0.631 . . . . 0.0 110.555 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 83' ' ' GLN . 49.2 t0 -94.03 74.91 4.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.737 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.431 HD13 ' CE1' ' A' ' 110' ' ' TYR . 82.5 mt -47.37 154.21 0.86 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.357 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -38.61 166.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 124.82 3.68 . . . . 0.0 114.894 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.78 -9.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 124.312 3.341 . . . . 0.0 115.545 -178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.04 -34.82 63.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.087 0.403 . . . . 0.0 109.987 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.876 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.6 tp -107.79 -77.88 0.59 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -61.7 -52.03 65.95 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -178.138 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.44 -50.57 66.32 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.343 -0.932 . . . . 0.0 114.82 -177.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.84 -43.74 74.87 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 95' ' ' LEU . 97.1 mt -68.23 -39.19 82.4 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 120.69 -0.404 . . . . 0.0 112.054 -179.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.0 p -71.6 -27.99 63.5 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.357 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.72 -57.54 3.01 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.36 -45.26 96.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.63 HD11 HD12 ' A' ' 49' ' ' LEU . 97.6 mt -70.69 -22.49 62.46 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.68 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.6 t0 -61.11 -36.5 79.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.981 0.42 . . . . 0.0 110.872 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.3 m -88.06 11.45 16.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.119 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 46.2 t -62.16 143.24 57.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.564 0.697 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -131.9 36.97 3.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.393 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.64 -13.96 66.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.925 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.84 96.29 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.56 -25.5 9.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.11 0.481 . . . . 0.0 110.561 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.457 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 77.22 109.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.184 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.1 p90 -52.7 -49.85 64.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.377 0.588 . . . . 0.0 110.625 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.437 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.5 ptt180 -83.91 -0.38 51.15 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.485 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.43 -45.96 93.7 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.704 -177.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.63 HD12 HD11 ' A' ' 37' ' ' LEU . 90.6 mt -74.86 -44.14 50.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.213 0.53 . . . . 0.0 111.17 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -39.91 94.5 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.0 tp10 -59.23 -44.45 92.31 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.522 0.514 . . . . 0.0 111.371 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 mtt85 -65.5 -41.01 93.68 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.708 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.815 HD23 HD21 ' A' ' 77' ' ' LEU . 52.5 tp -70.47 -44.6 67.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.531 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.3 m -144.11 139.65 28.99 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.689 0.28 . . . . 0.0 111.212 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.0 m -123.85 126.53 46.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.734 0.302 . . . . 0.0 110.928 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -159.26 139.41 12.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.51 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -66.79 -39.48 87.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.32 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.95 -39.06 87.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.943 0.402 . . . . 0.0 110.851 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.469 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.4 t70 -63.23 -44.18 95.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.767 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.805 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.1 m -64.47 -30.35 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -63.31 -41.12 98.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 0.0 110.652 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.452 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -77.17 -22.33 52.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.174 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.805 HD12 ' HA ' ' A' ' 60' ' ' VAL . 78.9 mt -60.2 -42.62 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.9 0.381 . . . . 0.0 110.835 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 67' ' ' VAL . 80.3 mm-40 -71.48 -20.99 62.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.531 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -72.11 -46.66 55.8 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 67.3 mm-40 -89.78 -2.98 58.37 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -177.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 63' ' ' ILE . 16.2 m -55.43 -32.22 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.95 0.795 . . . . 0.0 111.942 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -88.44 -5.63 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.471 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -107.97 18.21 21.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.51 23.5 7.92 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.113 -1.042 . . . . 0.0 114.934 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 95.3 143.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.249 1.02 . . . . 0.0 112.559 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.612 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.1 t -132.64 -32.13 1.31 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.301 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.31 -67.39 1.99 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.697 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.2 m -86.89 -36.35 18.46 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.652 0.263 . . . . 0.0 111.283 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.98 -47.98 83.94 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.4 tt0 -61.42 -43.18 99.32 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.575 0.226 . . . . 0.0 111.26 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.815 HD21 HD23 ' A' ' 53' ' ' LEU . 59.1 tp -62.31 -45.46 93.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.115 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.527 HD22 ' HG3' ' A' ' 84' ' ' LYS . 94.5 mt -69.4 -38.72 78.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.853 0.359 . . . . 0.0 111.356 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 22.5 m95 -77.31 -5.87 51.12 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.7 m -59.1 -39.67 82.95 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -86.12 -89.95 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.987 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.39 -87.52 0.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.569 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 97.7 mm-40 -111.8 -53.95 2.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.876 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.5 ttpp -133.14 -43.88 0.86 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.938 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.8 t30 48.59 37.99 10.35 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.137 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 171.96 13.52 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.9 p -120.69 156.14 32.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.428 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -60.54 -38.62 78.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.106 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.58 -39.76 98.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.751 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.3 -45.73 90.03 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.623 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.18 -24.72 51.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.382 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.469 ' HA ' HD12 ' A' ' 95' ' ' LEU . 60.7 tp -59.83 -41.65 91.79 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.851 0.358 . . . . 0.0 110.85 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -62.55 -40.42 96.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.093 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.541 HG12 HD22 ' A' ' 49' ' ' LEU . 85.8 t -68.1 -40.07 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.11 178.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 33' ' ' LEU . 91.5 mt -61.09 -39.22 89.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.451 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -62.77 -39.33 93.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.568 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -62.37 -39.87 94.6 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.698 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -12.12 41.03 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.75 39.88 59.26 Favored Glycine 0 C--N 1.329 0.157 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.725 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -70.75 93.43 0.95 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.113 0.483 . . . . 0.0 110.608 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.64 ' O ' HG22 ' A' ' 104' ' ' ILE . 82.9 mtt85 -64.5 -42.25 95.94 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -66.59 -39.43 88.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.78 -39.07 87.49 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 101' ' ' ARG . 8.5 tp -62.83 -31.87 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.44 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -70.57 -41.2 72.72 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.71 0.29 . . . . 0.0 111.228 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.29 -22.19 30.79 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.558 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.8 tp -62.03 -20.49 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 120.93 0.395 . . . . 0.0 111.231 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.4 p -70.39 -12.54 61.65 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.663 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.87 -26.8 64.36 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.76 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.53 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 78.1 t80 -63.78 126.87 28.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.244 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -137.79 16.51 3.51 Favored Glycine 0 C--N 1.333 0.376 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.833 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.53 ' HB3' ' CE1' ' A' ' 110' ' ' TYR . . . -81.36 162.26 23.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.904 0.383 . . . . 0.0 111.172 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 26.9 m -119.83 164.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 93.1 mt -70.16 150.52 46.42 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.7 m 55.71 62.7 6.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -56.66 -37.16 98.3 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 123.178 2.585 . . . . 0.0 113.11 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.6 m -126.5 148.3 49.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -123.81 146.2 48.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -88.11 61.73 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.065 0.459 . . . . 0.0 110.539 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 80.2 p -96.77 -2.71 43.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -98.62 25.26 6.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.869 0.366 . . . . 0.0 111.578 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -63.3 -39.67 95.23 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.347 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -125.59 145.02 50.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.525 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.485 -1.175 . . . . 0.0 112.187 179.997 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 120.97 0.414 . . . . 0.0 110.855 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -126.71 148.4 49.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.634 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.377 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.73 -168.9 41.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.037 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.8 m 58.76 44.05 17.66 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.753 0.421 . . . . 0.0 111.75 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtm -75.4 143.89 42.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.82 157.69 43.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.7 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -71.66 154.08 50.96 Favored Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.628 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -154.72 167.86 28.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.51 -46.62 89.2 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.382 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 84.0 -172.34 49.54 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.539 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.84 138.93 52.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.667 0.27 . . . . 0.0 110.844 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -131.51 147.87 52.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.22 -145.58 12.74 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 121.037 -0.602 . . . . 0.0 111.65 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.86 -39.49 92.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.906 0.384 . . . . 0.0 110.932 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 16' ' ' LEU . 2.6 mm? -95.39 132.9 39.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.982 179.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.5 p -85.77 110.38 19.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.827 0.346 . . . . 0.0 111.468 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.03 -10.7 41.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.397 0.618 . . . . 0.0 110.552 178.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -107.28 21.46 17.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.373 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 t -78.77 130.87 36.23 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -176.84 2.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.012 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mp -79.88 -57.62 3.56 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -72.92 -35.35 67.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.584 0.707 . . . . 0.0 110.7 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.27 71.1 0.73 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.165 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.532 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.4 mt -49.34 157.1 0.94 Allowed Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.077 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -37.28 163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 124.478 3.452 . . . . 0.0 115.009 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -49.52 -9.09 0.12 Allowed 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 124.146 3.23 . . . . 0.0 114.95 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.682 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.19 -36.38 65.83 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 121.98 0.112 . . . . 0.0 110.995 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.934 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.02 -78.12 0.59 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.87 -47.6 84.25 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -52.92 49.39 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.333 -0.937 . . . . 0.0 114.73 -177.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.688 ' HB2' HD23 ' A' ' 106' ' ' LEU . 15.1 tm-20 -71.94 -43.88 64.5 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.89 -39.44 87.46 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.3 p -73.97 -30.83 62.71 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 120.121 -0.632 . . . . 0.0 111.838 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.4 -56.32 3.58 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.64 -45.22 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -177.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.428 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 83.9 mt -74.51 -17.34 60.77 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.165 -0.334 . . . . 0.0 111.42 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 7.3 t70 -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.028 0.442 . . . . 0.0 110.976 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 59.1 m -88.85 10.79 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.53 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.0 t -67.49 145.2 55.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.087 0.47 . . . . 0.0 111.199 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.95 50.75 2.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.72 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.96 -12.73 69.32 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.9 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.58 98.79 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 117.285 0.542 . . . . 0.0 110.992 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -120.52 -30.49 4.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.329 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.31 118.08 1.04 Allowed Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.544 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.404 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 6.4 p90 -56.0 -43.03 77.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.057 0.428 . . . . 0.0 110.348 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.0 ptt180 -83.66 0.44 46.93 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.419 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.3 -50.2 63.77 Favored Glycine 0 CA--C 1.516 0.148 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.914 -177.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -71.99 -42.0 66.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.288 0.544 . . . . 0.0 111.496 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.58 -42.71 91.45 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.33 -45.76 92.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.286 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH2' ' HG2' ' A' ' 97' ' ' GLU . 99.7 mtt180 -70.22 -36.64 74.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.716 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.665 HD22 HD21 ' A' ' 77' ' ' LEU . 3.3 tt -66.85 -44.43 81.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.767 -0.197 . . . . 0.0 111.214 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.3 p -158.38 158.69 34.72 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 111.533 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 65.7 m -135.35 145.33 47.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.748 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.576 ' OG ' ' HB2' ' A' ' 59' ' ' ASP . 98.5 p -156.82 163.56 39.07 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.607 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 21.3 t90 -70.78 129.83 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.473 -179.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 85.6 mt 63.65 18.22 10.96 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.642 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.576 ' HB2' ' OG ' ' A' ' 56' ' ' SER . 37.4 t70 -64.05 -41.02 97.53 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.886 0.374 . . . . 0.0 111.513 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.748 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.8 m -67.7 -20.07 25.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -60.75 -47.92 84.15 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.762 0.315 . . . . 0.0 110.774 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.46 -28.15 61.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.559 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 60' ' ' VAL . 84.8 mt -60.1 -44.05 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.331 0.586 . . . . 0.0 110.03 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -66.78 -37.09 83.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.249 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.96 -46.71 86.44 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.0 mt-10 -89.78 -4.28 57.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.4 p -56.87 -33.31 41.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 118.361 0.528 . . . . 0.0 111.141 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.87 -4.36 58.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.931 0.396 . . . . 0.0 110.842 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -106.58 21.61 17.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.84 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.641 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.94 21.56 9.5 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.233 -0.984 . . . . 0.0 114.282 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.641 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.1 OUTLIER 95.24 147.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.602 1.161 . . . . 0.0 111.667 177.687 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.3 t -134.8 -36.57 0.84 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.401 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.22 -66.0 2.61 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.486 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 20.6 m -86.18 -37.51 18.63 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 122.352 -0.499 . . . . 0.0 111.273 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -60.95 -47.17 87.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.1 tt0 -62.32 -42.17 99.15 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.626 0.25 . . . . 0.0 110.817 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.665 HD21 HD22 ' A' ' 53' ' ' LEU . 63.2 tp -61.32 -46.24 91.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.578 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.5 mt -70.06 -39.13 75.86 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.432 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -79.57 -4.88 53.52 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.2 m -58.37 -39.77 80.47 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -86.37 -90.01 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.959 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.96 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.3 0.571 . . . . 0.0 109.724 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -111.88 -57.11 2.31 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.934 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.0 ttpp -132.24 -43.45 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.184 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.24 34.72 4.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.816 0.847 . . . . 0.0 111.647 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.36 170.89 15.11 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.6 p -122.57 158.72 29.29 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.336 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.647 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.39 -40.82 82.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.144 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.86 98.26 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.719 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.67 -45.86 88.19 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.558 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.78 -24.5 52.89 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.5 tp -60.03 -40.8 90.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.409 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.41 -43.21 99.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.937 0.399 . . . . 0.0 110.791 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.464 HG21 HD12 ' A' ' 53' ' ' LEU . 81.4 t -70.3 -40.05 77.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 121.618 0.723 . . . . 0.0 109.65 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 100' ' ' HIS . 50.1 tp -60.85 -40.47 93.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.26 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -61.66 -38.88 89.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.407 ' HG2' ' NH2' ' A' ' 52' ' ' ARG . 86.3 tt0 -62.66 -42.4 99.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 52.2 tpp -70.61 -40.0 73.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.379 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 81.75 40.09 11.2 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.578 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.662 ' HB3' HD11 ' A' ' 95' ' ' LEU . 20.7 t-160 -75.84 111.79 11.56 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.373 0.606 . . . . 0.0 110.73 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.32 -43.04 92.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.552 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.4 tpp180 -69.74 -38.72 76.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.11 -42.04 93.86 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.501 ' O ' HG22 ' A' ' 107' ' ' ILE . 46.8 pt -70.66 -27.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.868 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.82 -49.91 70.99 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.214 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' A' ' 32' ' ' GLU . 12.3 tp -83.92 -22.92 31.39 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.682 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.2 tt -61.84 -21.75 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.107 0.48 . . . . 0.0 111.148 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 54.3 m -62.17 -25.32 67.7 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.399 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -70.33 -14.15 62.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.532 ' HE1' HD22 ' A' ' 25' ' ' LEU . 72.0 t80 -69.97 127.76 34.0 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.755 0.312 . . . . 0.0 110.587 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -151.74 41.38 0.74 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.659 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.26 131.42 51.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 0.0 110.982 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 19.1 m -108.47 3.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.56 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.6 tp -108.75 121.6 45.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.8 m -131.5 149.41 73.47 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.106 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.25 145.15 53.5 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.331 2.021 . . . . 0.0 112.603 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 79.9 p -96.74 -6.56 36.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.329 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -138.06 135.51 35.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.272 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -72.87 136.46 45.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.8 m -134.66 153.28 52.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.371 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -109.5 128.8 55.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.698 0.285 . . . . 0.0 110.277 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.413 ' HG3' ' HG2' ' A' ' 123' ' ' GLU . 70.1 tp60 -130.04 127.77 40.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.114 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.413 ' HG2' ' HG3' ' A' ' 122' ' ' GLN . 11.5 mm-40 57.06 39.31 29.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.516 0.51 . . . . 0.0 111.593 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.215 179.978 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 120.84 0.353 . . . . 0.0 110.812 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.47 -38.99 92.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.355 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -125.71 148.39 49.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.49 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -152.1 163.96 30.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.127 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 91.9 p -73.46 160.34 31.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.909 0.385 . . . . 0.0 111.378 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.1 mtp -126.12 147.29 49.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -148.01 156.55 42.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.902 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.53 174.76 42.63 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.0 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -108.19 137.95 45.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.778 0.323 . . . . 0.0 110.681 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 52.8 t -124.22 126.96 46.98 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.494 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -145.82 156.27 26.89 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.139 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -152.23 158.33 42.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 0.148 . . . . 0.0 110.868 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 64.53 -157.65 0.3 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.664 0.603 . . . . 0.0 111.603 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.0 -179.37 42.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.387 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.3 -89.33 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.18 0.592 . . . . 0.0 111.698 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.7 tp -108.16 125.45 51.64 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -75.19 109.92 9.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.106 0.479 . . . . 0.0 111.275 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 -7.75 52.59 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.928 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -103.9 21.47 16.27 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.295 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -70.67 119.72 15.24 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.36 161.67 12.1 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.071 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.03 -50.5 66.0 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -81.24 -35.65 30.95 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.43 0.633 . . . . 0.0 111.341 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.52 70.77 0.72 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.627 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.514 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.3 mt -46.11 156.28 0.48 Allowed Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 123.904 0.753 . . . . 0.0 111.372 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -38.43 165.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 124.91 3.74 . . . . 0.0 114.725 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -49.33 -9.35 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.041 3.16 . . . . 0.0 114.996 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.69 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.48 -35.9 63.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.374 0.13 . . . . 0.0 110.734 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.895 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.74 -78.8 0.59 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 61.6 tp -61.42 -48.02 83.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.76 -51.52 58.14 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.654 -0.784 . . . . 0.0 114.467 -177.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.634 ' HB2' HD22 ' A' ' 106' ' ' LEU . 37.4 tp10 -70.57 -43.39 69.56 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.63 -39.34 88.24 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -71.78 -30.34 65.45 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 120.55 -0.46 . . . . 0.0 111.712 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.23 -56.75 3.38 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.3 t -64.26 -44.51 97.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.07 -19.15 61.86 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.351 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.495 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.0 t70 -59.75 -38.91 83.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 110.747 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.9 m -88.71 6.3 39.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.989 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.0 t -65.69 141.48 58.35 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.256 0.55 . . . . 0.0 111.536 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -132.68 50.68 2.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.252 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.98 -11.64 71.65 Favored Glycine 0 CA--C 1.52 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 113.49 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.8 98.52 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 117.253 0.527 . . . . 0.0 111.066 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -119.94 -23.31 6.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.909 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.47 111.69 0.2 Allowed Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.285 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 21.3 p90 -54.08 -44.4 71.14 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.235 0.518 . . . . 0.0 110.88 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.704 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.71 -0.08 52.32 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.781 178.249 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.96 -45.38 95.23 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.446 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.484 HD22 HG12 ' A' ' 94' ' ' VAL . 87.0 mt -71.55 -42.92 67.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.847 0.323 . . . . 0.0 111.163 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.808 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.34 -43.26 91.48 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.41 -40.08 95.35 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.694 -178.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -44.8 96.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.791 HD23 HD11 ' A' ' 77' ' ' LEU . 57.3 tp -70.3 -45.43 66.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.172 179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.0 m -148.53 138.93 22.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.665 0.269 . . . . 0.0 111.149 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.7 m -122.95 121.06 35.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.712 0.291 . . . . 0.0 111.674 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -159.82 158.37 30.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.994 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 30.1 m-90 -69.46 -38.99 78.01 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.788 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.3 mt -65.46 -40.28 93.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.912 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.428 ' O ' HG13 ' A' ' 63' ' ' ILE . 36.9 t70 -63.91 -46.07 86.45 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.776 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.7 m -70.87 -23.54 23.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.19 -46.48 88.75 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.982 0.42 . . . . 0.0 110.576 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 12.7 t60 -73.89 -25.97 60.29 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.287 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 60' ' ' VAL . 81.2 mt -59.4 -42.25 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.068 0.461 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.474 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -69.51 -27.44 65.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.029 179.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -70.26 -50.07 43.38 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.322 1.231 . . . . 0.0 114.322 -178.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.2 mt-10 -89.53 -3.56 58.28 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.7 p -55.54 -34.62 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 118.158 0.435 . . . . 0.0 111.308 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.17 -4.12 58.36 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.942 0.401 . . . . 0.0 110.76 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -105.68 21.88 16.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.796 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.612 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.14 22.26 8.88 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.266 -0.969 . . . . 0.0 114.363 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 94.18 140.16 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.251 1.02 . . . . 0.0 112.212 177.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.9 t -131.87 -25.82 2.03 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.483 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.584 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.01 -66.19 3.03 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.023 -1.084 . . . . 0.0 112.11 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.422 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 21.4 m -87.58 -36.63 17.43 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.428 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.3 ttt180 -60.37 -47.95 83.86 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.744 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.57 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.3 tt0 -63.04 -40.61 98.24 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.868 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.808 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.15 -46.16 91.68 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.3 mt -68.74 -39.37 80.36 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.241 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -78.07 -5.64 52.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.3 m -58.92 -39.74 82.46 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -85.99 -89.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.42 -86.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -114.68 -54.01 2.61 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.895 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.62 -44.9 0.89 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.8 t30 47.87 32.17 2.63 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.221 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.509 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.38 132.57 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -81.95 160.45 23.35 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.65 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.562 HG23 HD11 ' A' ' 107' ' ' ILE . 1.2 mp -60.31 -38.94 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.122 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.99 -39.04 97.59 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.726 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.32 -46.26 89.52 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.59 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.55 -24.38 45.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 -179.619 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 107' ' ' ILE . 61.4 tp -59.45 -40.53 87.16 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.627 0.251 . . . . 0.0 111.077 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -62.29 -41.3 98.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.559 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.484 HG12 HD22 ' A' ' 49' ' ' LEU . 87.5 t -69.63 -40.19 79.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.032 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 91' ' ' LEU . 3.7 mp -59.31 -36.95 76.55 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.241 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 92' ' ' LEU . 99.0 mm-40 -62.97 -39.9 96.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.287 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -62.57 -46.08 89.98 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.789 0.328 . . . . 0.0 110.718 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.1 mmt -70.36 -36.59 74.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.15 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 101' ' ' ARG . . . 93.53 40.61 4.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.245 -0.979 . . . . 0.0 111.983 -179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -76.89 86.95 3.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.317 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 99' ' ' GLY . 1.4 mpp_? -63.18 -43.35 98.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.529 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -63.32 -39.9 95.85 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.688 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.472 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.87 -37.79 83.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.569 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.3 mt -60.21 -43.18 92.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.615 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -63.93 -43.21 96.59 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.634 HD22 ' HB2' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -84.44 -23.05 30.13 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.106 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.69 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.7 tt -64.74 -20.96 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.845 0.355 . . . . 0.0 111.632 -179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 79.7 p -69.08 -16.7 63.74 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.448 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -71.73 -14.65 62.08 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.576 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.514 ' HE1' HD22 ' A' ' 25' ' ' LEU . 63.8 t80 -60.25 -48.39 81.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.287 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 76.6 71.31 1.19 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.468 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.38 58.77 1.73 Allowed 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 74.9 t -65.74 -43.38 93.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.159 0.504 . . . . 0.0 110.444 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -148.0 165.53 30.46 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 49.1 m -80.22 123.73 83.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.875 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 115' ' ' SER . 76.2 Cg_exo -55.73 -35.22 92.92 Favored 'Trans proline' 0 N--CA 1.48 0.688 0 C-N-CA 123.245 2.63 . . . . 0.0 113.099 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.2 p -63.82 -24.48 67.77 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.691 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 56.24 40.79 29.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 122.996 0.518 . . . . 0.0 112.217 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -85.28 67.93 10.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.995 0.426 . . . . 0.0 110.971 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 90.9 p -71.25 -21.18 62.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.524 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -116.75 128.11 55.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.633 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -104.94 140.57 37.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.703 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.08 -39.43 94.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.335 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.233 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.997 0.427 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -122.87 142.97 50.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.613 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -127.91 145.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.45 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.22 -179.32 42.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.148 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.7 p -96.07 134.2 39.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.732 0.301 . . . . 0.0 110.705 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 61.5 mtt -131.48 -52.62 1.01 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.102 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.79 56.58 6.54 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.64 0.588 . . . . 0.0 112.069 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -61.79 -40.65 99.09 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.053 -0.594 . . . . 0.0 113.273 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 53.87 41.13 32.15 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.0 m -124.93 152.04 44.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.927 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.27 161.72 8.93 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.532 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.84 152.09 32.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 122.038 0.135 . . . . 0.0 110.682 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 -127.88 -65.89 0.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.994 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.47 156.04 30.23 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.692 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.93 -39.84 95.08 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.94 0.4 . . . . 0.0 111.604 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -108.48 149.31 28.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.197 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -72.41 108.71 5.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.134 0.492 . . . . 0.0 111.154 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.23 -7.67 50.61 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.968 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -103.86 21.62 15.98 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.586 -179.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.8 m -75.61 117.44 17.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.652 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.9 169.21 21.63 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.735 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -64.18 -50.52 67.79 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.418 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . 99.7 m-85 -91.92 -35.68 13.88 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.277 0.56 . . . . 0.0 111.133 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.9 70.76 1.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.307 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.542 HD22 ' HE2' ' A' ' 110' ' ' TYR . 94.0 mt -47.43 156.32 0.64 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.642 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.55 166.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.257 3.972 . . . . 0.0 114.977 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.89 -8.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.232 0 C-N-CA 124.112 3.208 . . . . 0.0 115.312 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.7 -36.55 67.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 118.025 0.375 . . . . 0.0 110.219 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.97 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.66 -78.37 0.59 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.9 tp -61.11 -48.72 80.35 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.07 -51.26 59.54 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 120.473 -0.87 . . . . 0.0 114.343 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.467 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.39 -43.28 70.37 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.22 -37.89 84.35 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.61 -0.436 . . . . 0.0 112.085 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.7 p -75.28 -31.7 60.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.774 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.97 -56.89 3.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.439 HG11 ' HG2' ' A' ' 102' ' ' ARG . 61.4 t -63.49 -44.77 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 100' ' ' HIS . 70.5 mt -72.84 -19.42 61.31 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.187 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.621 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 39.6 t0 -62.02 -36.19 80.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.168 0.508 . . . . 0.0 110.158 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.8 m -88.1 7.41 31.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.996 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.7 t -62.76 142.77 58.02 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.411 0.624 . . . . 0.0 111.717 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -130.35 40.0 3.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.849 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.15 -11.96 69.81 Favored Glycine 0 CA--C 1.519 0.3 0 CA-C-N 115.456 -0.793 . . . . 0.0 113.094 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.77 -42.88 97.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.967 0.383 . . . . 0.0 111.654 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 92.0 mt -113.8 -22.06 10.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.078 0.466 . . . . 0.0 110.5 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.705 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.4 p90 -52.12 -52.38 51.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 117.107 0.454 . . . . 0.0 110.641 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.55 0.64 45.7 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.752 178.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.74 -47.08 91.03 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.158 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 HG12 ' A' ' 94' ' ' VAL . 94.7 mt -73.38 -43.19 61.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.96 0.38 . . . . 0.0 111.376 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.709 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.72 -40.73 95.82 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -60.68 -43.74 97.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.243 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -64.79 -41.11 96.08 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.881 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 77' ' ' LEU . 55.8 tp -68.08 -44.2 76.82 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.943 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.1 m -141.86 127.11 18.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.737 0.303 . . . . 0.0 110.871 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 m -115.01 99.58 7.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.666 0.27 . . . . 0.0 110.585 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.4 m -131.67 146.62 52.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.931 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.478 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 48.8 t-105 -81.15 150.89 28.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.539 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 57' ' ' TRP . 83.9 mt 77.32 -30.65 0.17 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.862 0.865 . . . . 0.0 112.167 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -62.88 -35.48 80.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.678 0.275 . . . . 0.0 111.376 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.685 ' HA ' HD12 ' A' ' 63' ' ' ILE . 19.0 m -59.84 -20.65 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.31 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -63.54 -42.4 98.41 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.837 0.351 . . . . 0.0 110.411 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -68.17 -29.27 68.1 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.397 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.685 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.9 mt -60.01 -42.8 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.433 0.635 . . . . 0.0 109.63 178.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.19 -35.93 76.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.172 178.338 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -62.78 -47.59 82.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.528 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.1 mt-10 -89.56 -3.62 58.23 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.1 p -57.13 -32.48 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 118.18 0.445 . . . . 0.0 111.146 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.83 -4.67 58.43 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.922 0.391 . . . . 0.0 110.693 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -106.38 21.56 17.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.728 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.606 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 22.3 8.9 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.391 -0.909 . . . . 0.0 114.254 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 93.75 142.65 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.279 1.032 . . . . 0.0 112.129 177.512 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.6 t -130.74 -31.74 1.73 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.964 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.447 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.44 -62.99 5.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.299 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.515 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.14 -37.3 16.29 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.384 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.8 ttt180 -62.3 -47.41 84.41 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.56 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.7 tt0 -63.25 -40.02 96.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.734 0.302 . . . . 0.0 110.632 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.709 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.3 tp -61.16 -46.38 90.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.171 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.479 HD22 ' HG3' ' A' ' 84' ' ' LYS . 86.1 mt -71.17 -40.21 71.42 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.998 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -82.52 -5.94 59.03 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -59.13 -41.94 89.45 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -85.8 -89.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.48 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.19 -86.91 0.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.293 0.568 . . . . 0.0 110.596 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.418 ' OE1' ' HB2' ' A' ' 23' ' ' PHE . 91.8 mt-30 -112.46 -57.23 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.97 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.8 ttpp -131.73 -42.45 1.02 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.2 t30 49.28 30.44 3.16 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.135 0.974 . . . . 0.0 111.857 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 9.6 mptt -139.57 164.24 30.42 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.0 p -124.95 160.16 29.55 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.539 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.8 mp -59.45 -41.85 85.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.971 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.81 99.4 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.914 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.74 -40.28 95.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.629 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -74.87 -29.42 61.01 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.7 -179.58 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.566 HD21 HG12 ' A' ' 107' ' ' ILE . 74.4 mt -59.6 -37.51 78.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -58.97 -46.49 87.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.286 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.472 HG12 HD22 ' A' ' 49' ' ' LEU . 92.6 t -70.51 -39.57 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.727 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.0 mp -57.78 -39.47 77.55 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.35 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -63.8 -38.85 92.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.142 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -63.17 -40.6 98.0 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.913 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 95.7 mmm -90.4 -10.75 42.73 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.9 39.73 46.02 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.853 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.405 ' CD2' HD21 ' A' ' 37' ' ' LEU . 16.1 m80 -74.28 81.39 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.085 0.469 . . . . 0.0 111.579 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -63.21 -42.2 99.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.57 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.439 ' HG2' HG11 ' A' ' 36' ' ' VAL . 22.2 tpp85 -62.21 -41.55 98.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.025 0.44 . . . . 0.0 110.761 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.47 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.27 -39.17 89.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.305 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.5 mt -62.66 -42.89 97.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.631 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.16 -41.45 99.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.706 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.467 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.36 -23.51 37.67 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.599 HG22 ' O ' ' A' ' 104' ' ' ILE . 0.9 OUTLIER -64.82 -20.3 27.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.859 0.362 . . . . 0.0 111.251 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.0 p -71.03 -7.25 45.06 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.604 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -68.62 -27.1 65.73 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.758 0.313 . . . . 0.0 110.978 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.542 ' HE2' HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -103.3 106.95 17.59 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -61.78 -40.17 98.45 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.012 -0.54 . . . . 0.0 114.135 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -127.18 147.92 50.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.949 0.374 . . . . 0.0 110.91 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.2 t -96.72 121.23 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.92 0.391 . . . . 0.0 110.401 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -107.48 125.97 51.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.2 m -109.69 105.18 56.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.872 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.5 158.73 43.85 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.831 2.354 . . . . 0.0 112.557 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 m -64.06 137.89 58.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.509 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -123.08 134.88 54.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.788 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.74 -39.59 93.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.223 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 t 61.22 -155.22 0.36 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.228 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 54.62 -124.63 2.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 123.593 0.558 . . . . 0.0 111.233 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 56.48 -113.14 0.74 Allowed 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.422 0.452 . . . . 0.0 111.408 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -125.33 143.27 51.05 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.522 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.475 -1.18 . . . . 0.0 112.262 179.999 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 121.035 0.445 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -120.03 135.76 54.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.473 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -103.73 5.71 36.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.482 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.03 -155.21 49.03 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.446 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 51.0 m 56.46 45.55 22.36 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.966 0.412 . . . . 0.0 111.56 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 64' ' ' GLU . 75.4 mtm -125.31 147.47 49.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.162 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.6 160.9 42.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.041 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -158.75 -179.91 33.94 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.413 -0.899 . . . . 0.0 112.858 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -148.46 -179.97 7.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.403 0.281 . . . . 0.0 110.473 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.6 m -114.76 148.89 37.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.817 0.341 . . . . 0.0 111.157 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.63 143.56 15.97 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.344 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.24 95.86 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 68.61 -84.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.725 0.64 . . . . 0.0 111.234 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 99.99 155.53 28.03 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.934 -0.65 . . . . 0.0 113.039 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.06 -40.78 97.03 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.824 0.345 . . . . 0.0 111.712 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.3 mt -81.62 144.29 31.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.355 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.6 p -81.63 110.15 16.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.862 0.363 . . . . 0.0 111.463 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.96 -11.13 39.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.28 0.562 . . . . 0.0 110.587 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -108.76 21.03 17.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.559 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.7 t -72.43 125.46 27.44 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.229 0.538 . . . . 0.0 112.422 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -167.56 -178.21 3.85 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.586 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -80.38 -58.98 2.88 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.387 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -72.9 -35.4 67.09 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.608 0.718 . . . . 0.0 110.691 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -110.56 71.33 0.75 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.092 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.604 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.3 mt -48.24 156.54 0.77 Allowed Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -36.12 163.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.632 3.555 . . . . 0.0 115.176 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -50.52 -8.9 0.16 Allowed 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 123.978 3.119 . . . . 0.0 114.634 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.688 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.17 -35.59 64.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.3 -79.5 0.58 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 62.4 tp -62.3 -47.68 83.21 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.45 -52.26 53.71 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.593 -0.813 . . . . 0.0 114.645 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -71.12 -43.23 68.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.35 -39.73 89.37 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.0 p -73.13 -30.14 63.4 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.847 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -55.82 3.81 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.63 -45.25 95.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.678 ' HB2' ' HZ1' ' A' ' 71' ' ' LYS . 82.6 mt -74.39 -17.82 60.75 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.713 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 19.3 t70 -59.56 -38.74 81.9 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.104 0.478 . . . . 0.0 110.541 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.6 p -90.29 10.04 26.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.354 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -66.5 147.24 53.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.18 0.514 . . . . 0.0 111.237 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -136.53 49.54 2.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.242 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.94 -10.3 74.77 Favored Glycine 0 CA--C 1.519 0.34 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.422 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.64 99.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 111.154 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -122.38 -32.39 3.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.17 114.92 1.4 Allowed Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.583 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.47 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 9.0 p90 -55.15 -44.17 74.86 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.036 0.418 . . . . 0.0 110.572 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.738 ' HB3' HD13 ' A' ' 63' ' ' ILE . 1.5 ppt_? -84.83 -0.5 54.14 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.728 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -48.69 83.41 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.299 -177.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 95' ' ' LEU . 95.0 mt -73.28 -41.82 63.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.9 0.381 . . . . 0.0 111.214 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.74 -43.1 97.47 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -60.73 -44.38 96.72 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.368 0.417 . . . . 0.0 111.636 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -67.91 -40.59 83.39 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 77' ' ' LEU . 56.6 tp -70.09 -45.47 66.91 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.6 m -144.52 150.83 38.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.245 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 89.6 p -142.72 152.71 42.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.699 0.285 . . . . 0.0 110.961 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.8 t -162.72 178.75 8.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.611 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.6 m0 -82.81 129.45 34.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.495 0.188 . . . . 0.0 110.805 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.9 mt 57.7 30.06 18.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.099 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.11 -20.44 61.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.817 ' HA ' HD12 ' A' ' 63' ' ' ILE . 32.4 m -75.82 -17.16 15.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -60.85 -47.65 85.4 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.246 -178.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 30.4 p80 -78.69 -19.11 53.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.823 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 60' ' ' VAL . 77.8 mt -61.96 -41.18 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 121.303 0.573 . . . . 0.0 110.457 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 67' ' ' VAL . 96.3 mt-10 -69.55 -34.0 73.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.995 178.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.2 mttt -62.4 -47.98 81.74 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.4 mm-40 -89.5 -4.31 57.98 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.7 p -57.11 -30.82 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 118.233 0.47 . . . . 0.0 110.894 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -88.33 -5.22 58.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.12 0.486 . . . . 0.0 110.596 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -109.36 22.91 15.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.766 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.682 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.61 11.55 30.59 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-O 118.858 -0.968 . . . . 0.0 114.633 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.682 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 105.73 147.76 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.112 1.365 . . . . 0.0 111.744 177.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.614 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.6 t -132.34 -26.06 1.9 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.762 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.92 -66.56 2.71 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 119.036 -1.554 . . . . 0.0 111.007 178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -87.03 -40.02 15.1 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 71' ' ' LYS . 76.0 ttt-85 -61.55 -47.91 83.41 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.9 tp10 -61.75 -43.05 99.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.515 0.198 . . . . 0.0 110.859 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 53' ' ' LEU . 60.1 tp -63.59 -45.74 89.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.588 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.594 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.1 mt -67.16 -39.11 86.45 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.888 0.375 . . . . 0.0 111.178 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -78.2 -6.27 54.34 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.2 m -59.18 -39.74 83.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -85.9 -90.14 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.198 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.98 -86.49 0.5 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.168 0.509 . . . . 0.0 109.679 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -111.16 -57.61 2.22 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.2 ttpp -133.13 -42.76 0.88 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.71 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.0 t30 49.4 32.84 4.89 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.153 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.536 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.59 130.4 26.07 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.72 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 51.5 p -81.55 160.2 23.94 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.991 -0.683 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.5 -38.4 77.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.041 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.4 -39.32 97.62 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.915 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.98 -45.19 93.58 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.655 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -78.01 -23.94 48.1 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.397 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 107' ' ' ILE . 62.2 tp -58.98 -40.92 86.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.087 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -61.92 -41.48 97.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 110.265 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 76.5 t -67.98 -41.55 84.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.154 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.5 mp -60.15 -39.21 85.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.119 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -62.94 -40.63 98.23 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -65.19 -42.89 93.17 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.566 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.43 -38.56 81.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.196 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.69 26.15 39.51 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.612 -0.804 . . . . 0.0 113.464 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.413 ' NE2' ' HB3' ' A' ' 102' ' ' ARG . 20.7 t-160 -77.48 106.16 9.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.098 0.449 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.96 -42.23 97.33 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.413 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.2 tpp180 -62.57 -42.25 99.43 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.865 0.364 . . . . 0.0 110.96 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.63 -42.04 98.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.497 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.653 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.2 mt -64.24 -43.28 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.38 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -61.0 -47.96 84.03 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.443 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -76.99 -24.94 52.22 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.688 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.9 tt -64.7 -20.68 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 120.816 0.341 . . . . 0.0 111.723 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 72.2 p -75.62 -8.09 55.92 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.595 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -87.49 16.09 5.88 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.029 0.442 . . . . 0.0 111.238 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.604 ' HE1' HD22 ' A' ' 25' ' ' LEU . 58.9 t80 -83.33 127.9 34.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.672 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -104.32 154.42 17.58 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.067 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.09 141.77 58.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.874 0.369 . . . . 0.0 111.349 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 26.9 m -128.52 159.73 39.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.886 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 mp -95.3 137.16 34.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.744 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.7 m -80.03 125.64 81.34 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.61 151.38 64.2 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.724 2.282 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.2 m -93.43 -0.05 56.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.299 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -99.48 140.29 33.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.79 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -147.51 156.19 42.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.802 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.9 m -95.2 -2.05 50.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.394 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -92.44 93.45 8.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.041 0.448 . . . . 0.0 110.254 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -100.78 0.99 39.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.5 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -63.09 -41.54 99.43 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.357 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.499 -1.167 . . . . 0.0 112.663 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 121.014 0.435 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -105.28 126.69 52.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -119.8 142.23 48.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.517 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.9 173.39 42.45 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.601 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.0 m -130.75 150.5 51.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.695 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtm -105.81 137.8 43.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.506 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.58 97.51 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.922 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.07 179.98 50.97 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.553 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -106.19 117.98 35.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.627 0.251 . . . . 0.0 110.749 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 36' ' ' VAL . 97.3 m -64.93 -40.31 94.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.531 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 119.92 -175.25 15.83 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.235 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -106.68 120.98 43.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.728 0.264 . . . . 0.0 110.919 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -137.64 167.26 22.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.015 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.439 ' HA2' ' OD1' ' A' ' 109' ' ' ASN . . . 103.81 -17.18 49.95 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.83 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -104.14 -70.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.924 0.393 . . . . 0.0 110.514 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.1 mt -109.84 139.08 45.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.261 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 p -103.53 110.04 21.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.059 0.457 . . . . 0.0 110.839 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.92 -7.25 54.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.162 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -105.25 21.27 17.43 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.209 -179.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -70.79 120.03 15.8 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.12 164.45 20.29 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.484 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.43 -50.37 70.03 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.62 -35.36 14.27 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.143 0.496 . . . . 0.0 111.589 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -103.61 70.8 1.04 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.46 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.0 mt -43.51 157.51 0.26 Allowed Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 124.283 0.989 . . . . 0.0 112.454 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -42.32 167.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 124.621 3.547 . . . . 0.0 113.845 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.73 -9.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.821 3.014 . . . . 0.0 115.083 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.5 -35.36 67.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.868 0.303 . . . . 0.0 110.937 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.834 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.0 tp -107.24 -77.55 0.6 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -49.75 71.11 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.34 -52.29 54.08 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.559 -0.829 . . . . 0.0 115.049 -177.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.8 tm-20 -71.28 -43.82 66.42 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.68 -39.58 88.2 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 19.2 p -74.32 -32.97 63.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.191 -0.604 . . . . 0.0 112.17 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.7 -54.52 4.48 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.458 HG11 ' HG2' ' A' ' 102' ' ' ARG . 56.9 t -64.19 -44.83 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.512 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 mt -75.64 -17.23 60.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.37 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 36.5 t0 -60.66 -37.13 80.56 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.054 0.454 . . . . 0.0 110.967 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.9 m -85.72 9.6 15.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.128 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.426 ' SG ' HD12 ' A' ' 44' ' ' LEU . 48.3 t -66.18 144.66 56.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.254 0.549 . . . . 0.0 111.883 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -133.63 46.26 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.87 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.4 -11.99 70.51 Favored Glycine 0 CA--C 1.519 0.33 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.391 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.82 -42.46 97.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.956 0.407 . . . . 0.0 111.551 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.426 HD12 ' SG ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -117.05 -26.15 6.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.308 179.095 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.403 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.63 108.07 0.25 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.165 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 16.0 p90 -54.89 -40.3 69.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 117.211 0.505 . . . . 0.0 111.125 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.607 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -83.04 1.06 41.99 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.996 178.769 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.71 -43.52 96.31 Favored Glycine 0 C--N 1.329 0.177 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.713 -178.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.561 HD12 ' HB ' ' A' ' 74' ' ' THR . 94.2 mt -71.41 -42.4 68.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.768 0.318 . . . . 0.0 111.003 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.54 -40.59 93.06 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.03 -41.11 97.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.996 -178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -41.11 96.9 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.854 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.472 ' HA ' HD22 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -71.09 -42.69 69.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.159 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 t 56.89 61.55 2.57 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.848 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.9 p -65.28 -39.91 93.2 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.847 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 87.5 p -161.25 159.96 29.31 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.82 0.343 . . . . 0.0 111.06 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -65.7 -42.75 90.82 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.831 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.78 1.48 38.75 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.6 -39.06 86.73 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.259 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.832 ' HA ' HD12 ' A' ' 63' ' ' ILE . 29.0 m -62.45 -26.9 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -63.24 -45.8 89.86 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.992 0.425 . . . . 0.0 110.672 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -74.38 -22.43 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.419 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.832 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.6 mt -59.86 -43.73 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.11 0.481 . . . . 0.0 110.5 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.517 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.9 mt-10 -66.94 -36.58 82.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.957 0.408 . . . . 0.0 110.935 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.34 -47.2 83.15 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -177.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 6.1 mt-10 -90.05 -4.08 57.59 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.1 p -56.54 -32.62 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.209 0.459 . . . . 0.0 111.235 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.82 -4.73 58.41 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.853 178.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -106.08 21.31 17.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.907 -178.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.64 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.62 21.15 10.01 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.259 -0.972 . . . . 0.0 114.233 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.64 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 98.9 148.01 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.568 1.147 . . . . 0.0 112.04 177.479 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.1 t -137.13 -37.26 0.65 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.659 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.649 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.68 -62.8 4.94 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.931 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.561 ' HB ' HD12 ' A' ' 49' ' ' LEU . 9.2 t -88.21 -36.06 16.99 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.266 0.533 . . . . 0.0 111.712 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.18 -47.27 85.24 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.2 tt0 -62.58 -40.14 95.93 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.645 0.26 . . . . 0.0 110.641 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.7 tp -61.51 -46.96 87.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.531 HD22 ' HG3' ' A' ' 84' ' ' LYS . 91.1 mt -72.26 -39.88 68.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.566 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -78.09 -6.77 55.71 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.9 p -57.86 -38.63 76.05 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.42 ' O ' ' HA ' ' A' ' 123' ' ' GLU . 67.0 m95 -87.38 -91.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.016 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.94 -86.8 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -108.7 -57.87 2.08 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.834 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.2 ttpp -133.07 -43.84 0.87 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.94 176.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.2 t30 47.97 34.7 4.3 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.556 0.742 . . . . 0.0 111.911 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -139.45 168.14 20.49 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 64.8 p -124.84 158.59 33.07 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.528 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 29' ' ' LEU . 1.2 mm -60.56 -37.66 75.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.924 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.91 -41.35 99.27 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.716 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.47 -42.34 83.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.057 0.456 . . . . 0.0 111.036 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -75.59 -24.14 56.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.802 -179.476 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.52 -42.14 91.57 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.945 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -62.09 -41.59 98.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.433 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -69.09 -41.24 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.062 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.706 HD13 HD12 ' A' ' 91' ' ' LEU . 2.0 mp -59.91 -42.96 95.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.253 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -63.9 -40.8 97.33 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.204 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -63.95 -46.71 83.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.4 mmm -70.29 -38.57 75.04 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.73 40.0 5.41 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.446 -0.883 . . . . 0.0 113.266 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.416 ' CE1' ' HB3' ' A' ' 44' ' ' LEU . 99.0 m-70 -78.44 97.18 5.58 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.994 0.397 . . . . 0.0 110.588 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.526 ' O ' HG12 ' A' ' 104' ' ' ILE . 83.6 mtp180 -63.67 -41.83 98.13 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.691 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.458 ' HG2' HG11 ' A' ' 36' ' ' VAL . 6.5 tpm_? -65.41 -37.56 87.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.044 0.449 . . . . 0.0 111.666 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.31 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.681 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.619 ' O ' HG22 ' A' ' 107' ' ' ILE . 36.9 pt -69.03 -25.76 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.429 -179.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -70.56 -39.97 73.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.863 0.364 . . . . 0.0 110.717 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.427 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -84.93 -22.8 29.11 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.737 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -61.97 -21.18 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.642 0.258 . . . . 0.0 111.328 -179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.4 t -65.77 -16.71 64.04 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.598 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASN . . . . . 0.439 ' OD1' ' HA2' ' A' ' 14' ' ' GLY . 27.4 m120 -78.1 -10.44 59.62 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 0.0 111.421 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -71.88 137.92 47.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.528 179.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 128.34 -7.06 6.7 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.582 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.034 0.445 . . . . 0.0 110.837 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 30.2 m -129.11 160.72 39.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.564 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.7 tp -87.63 126.16 34.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.585 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 74.6 m -70.1 147.05 95.48 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.67 146.8 55.53 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.375 2.05 . . . . 0.0 112.371 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.1 p -87.61 -11.18 49.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.193 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -129.06 149.19 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.824 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -77.42 153.73 33.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.546 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 89.5 p -66.14 -30.54 71.04 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.612 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 59.67 30.4 20.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.408 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -128.63 148.54 50.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.098 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 81' ' ' TRP . 98.7 mt-10 -118.74 133.48 55.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 110.754 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.344 -1.254 . . . . 0.0 112.495 179.827 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.136 0.493 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -149.35 158.27 44.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.719 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -127.87 148.19 50.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.731 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 121.57 105.87 1.95 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.234 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.8 p -157.62 167.08 31.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.609 0.242 . . . . 0.0 110.866 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.2 mtt -125.93 151.29 47.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.447 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.06 48.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.978 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.68 167.46 44.45 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.909 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -97.83 109.01 21.85 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.686 0.279 . . . . 0.0 110.661 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -121.9 129.36 52.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.438 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -70.37 145.86 41.47 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.913 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.81 30.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.856 0.36 . . . . 0.0 111.302 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -77.3 148.36 35.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.948 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -86.88 -174.25 49.09 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.95 -0.643 . . . . 0.0 113.051 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.93 94.19 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 111.665 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.35 121.19 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.138 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -83.07 108.28 16.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.183 0.516 . . . . 0.0 111.471 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.61 -7.45 50.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.902 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -103.42 21.76 15.42 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.442 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.418 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.4 m -78.64 113.91 17.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.504 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 20.6 mt -155.96 165.58 36.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.005 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.6 tp -62.77 -49.46 74.91 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -83.27 -35.39 25.35 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.156 0.503 . . . . 0.0 112.007 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -113.09 71.23 0.74 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.703 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.44 HD13 ' CE1' ' A' ' 110' ' ' TYR . 86.1 mt -41.0 155.4 0.21 Allowed Pre-proline 0 CA--C 1.54 0.577 0 O-C-N 123.926 0.766 . . . . 0.0 112.008 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.2 Cg_exo -38.01 164.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 125.041 3.827 . . . . 0.0 114.848 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.21 -9.17 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 124.131 3.221 . . . . 0.0 115.18 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.607 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.94 -35.55 64.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 117.634 0.197 . . . . 0.0 110.521 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.91 -79.12 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.21 -47.44 84.42 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -177.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.51 -51.12 60.69 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.523 -0.846 . . . . 0.0 114.14 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.96 -43.26 68.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.59 -38.68 84.38 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -73.97 -30.85 62.72 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.644 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.5 -57.35 3.1 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.66 -45.58 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 HD12 ' A' ' 49' ' ' LEU . 84.0 mt -72.61 -19.51 61.45 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.485 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 37.0 t0 -61.29 -37.29 82.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 110.28 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -85.69 1.65 48.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.014 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -63.45 139.34 58.76 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.224 0.535 . . . . 0.0 111.553 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.52 45.78 2.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.938 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.04 -10.96 73.01 Favored Glycine 0 CA--C 1.52 0.35 0 CA-C-N 115.535 -0.757 . . . . 0.0 113.127 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.11 98.76 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.994 0.397 . . . . 0.0 111.347 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.439 ' HG ' ' CD2' ' A' ' 100' ' ' HIS . 1.9 mm? -114.68 -23.6 9.15 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.78 110.37 0.3 Allowed Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.393 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.9 p90 -50.95 -50.35 58.11 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 117.293 0.546 . . . . 0.0 110.627 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.656 ' HB3' HG21 ' A' ' 63' ' ' ILE . 47.0 ptt85 -84.04 1.33 44.41 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.694 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.91 -49.11 73.56 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.3 -177.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.511 HD12 HD11 ' A' ' 37' ' ' LEU . 95.9 mt -71.25 -41.63 69.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.073 0.437 . . . . 0.0 111.372 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.68 -41.4 96.08 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -60.55 -42.63 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.934 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -64.23 -41.3 97.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.106 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.774 HD23 HD21 ' A' ' 77' ' ' LEU . 56.7 tp -70.41 -45.56 65.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.439 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.0 m -146.18 140.02 26.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.3 m -120.8 120.6 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.612 0.244 . . . . 0.0 110.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -158.1 141.34 15.11 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.61 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -62.47 -45.31 93.63 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' A' ' 58' ' ' LEU . 3.1 mm? -65.56 -38.74 90.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.64 -45.8 91.17 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.148 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.789 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.4 m -70.49 -25.33 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.816 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.61 -45.11 94.4 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.174 0.511 . . . . 0.0 109.937 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -70.74 -27.72 64.16 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.842 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.1 mt -59.97 -42.71 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.129 0.49 . . . . 0.0 110.572 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.4 mt-10 -65.92 -36.53 83.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.458 . . . . 0.0 110.847 178.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.53 -49.14 74.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -178.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.551 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 1.4 mm-40 -89.95 -3.45 58.03 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 6.2 p -56.18 -33.42 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 118.177 0.444 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.05 -4.34 58.4 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.808 0.337 . . . . 0.0 110.762 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.97 21.57 17.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.883 -178.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.86 20.79 10.24 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.282 -0.961 . . . . 0.0 114.269 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.0 OUTLIER 95.82 141.52 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.388 1.075 . . . . 0.0 112.161 177.493 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.7 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.4 t -131.12 -28.8 1.9 Allowed 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.331 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.486 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.23 -63.14 5.58 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.745 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.505 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.84 -40.12 13.36 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 179.224 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.55 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 76.9 ttt180 -62.31 -49.89 73.83 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -177.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.7 ' HB3' ' O ' ' A' ' 72' ' ' SER . 52.4 tp10 -64.51 -39.19 93.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.295 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.774 HD21 HD23 ' A' ' 53' ' ' LEU . 64.0 tp -60.51 -46.52 89.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.937 0.399 . . . . 0.0 110.338 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.487 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.7 mt -71.5 -39.59 70.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.195 0.522 . . . . 0.0 111.197 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -74.55 -6.47 48.65 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.616 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 t -58.03 -42.1 84.63 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 61.5 m95 -85.73 -90.05 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.988 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.71 -86.26 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.216 0.532 . . . . 0.0 109.575 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.48 -56.95 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.921 ' HD2' HD23 ' A' ' 29' ' ' LEU . 21.5 ttpp -132.02 -42.68 0.99 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.482 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 45.63 34.01 1.6 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.669 0.788 . . . . 0.0 112.563 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.5 169.01 18.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.3 p -119.38 158.32 26.41 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.469 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.23 -38.26 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.057 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.31 -39.6 97.95 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.824 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.83 -46.53 87.5 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.752 0.279 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.681 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.2 mm? -76.32 -24.49 54.31 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.286 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.07 -38.1 78.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -60.93 -41.83 96.98 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.839 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.09 -23.95 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.121 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.8 mp -62.78 -46.61 87.21 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 110.334 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.69 -39.44 91.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.626 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -63.29 -43.5 97.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.652 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -68.69 -38.75 80.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.88 22.86 19.51 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.095 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.439 ' CD2' ' HG ' ' A' ' 44' ' ' LEU . 13.1 t-160 -78.08 99.02 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.087 0.47 . . . . 0.0 110.996 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.69 -40.8 96.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.809 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.19 -41.4 96.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.856 0.36 . . . . 0.0 110.739 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -39.49 90.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.304 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.627 ' O ' HG22 ' A' ' 107' ' ' ILE . 44.2 mm -63.97 -43.66 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.749 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -64.64 -40.78 96.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.648 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -79.79 -22.78 42.72 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.627 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.5 tp -64.55 -20.84 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.511 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.1 p -74.09 -10.18 59.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -89.03 16.28 7.32 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.195 0.522 . . . . 0.0 111.187 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.44 ' CE1' HD13 ' A' ' 25' ' ' LEU . 38.7 t80 -88.54 127.17 35.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.307 179.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.62 77.9 0.24 Allowed Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.887 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -149.73 168.13 24.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.847 0.356 . . . . 0.0 111.33 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.9 m -89.11 36.02 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.277 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.92 -168.3 0.15 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.292 0.637 . . . . 0.0 111.795 179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 63.4 m -129.37 150.49 75.72 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.513 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.81 154.62 63.48 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.474 2.116 . . . . 0.0 112.382 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 64.1 m -105.67 141.81 36.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.834 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -125.82 145.75 50.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.637 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -126.93 149.6 49.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.585 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 98.7 p -150.24 160.74 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.611 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 54.5 p90 -149.1 161.53 41.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.486 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -150.12 159.5 44.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.668 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.68 -39.4 93.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.165 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.408 -1.218 . . . . 0.0 112.504 -179.949 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.92 0.391 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -124.76 145.61 49.63 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.561 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -150.31 160.78 43.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.645 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.68 146.53 32.74 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.498 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m -102.68 85.48 2.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.845 0.355 . . . . 0.0 111.03 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.6 mmt -123.13 140.53 52.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.116 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -148.77 151.54 34.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -104.11 -168.22 25.0 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.032 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -136.86 103.43 5.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -150.71 137.28 18.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.713 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -95.62 -160.14 33.07 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.606 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.76 147.07 53.97 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.448 0.166 . . . . 0.0 110.934 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -61.03 -46.85 89.04 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 154.0 169.93 19.41 Favored Glycine 0 CA--C 1.517 0.206 0 C-N-CA 120.299 -0.953 . . . . 0.0 113.113 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.35 -39.54 92.47 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -102.54 159.89 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.753 -179.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.463 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 2.8 p -95.91 109.06 21.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.083 0.468 . . . . 0.0 111.692 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.93 -10.23 40.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.241 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -103.79 21.6 15.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.369 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.2 m -67.64 119.66 12.76 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.74 0.305 . . . . 0.0 111.72 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.17 163.3 22.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.428 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.0 tp -64.38 -50.58 67.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -85.25 -35.38 21.6 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.565 0.697 . . . . 0.0 111.325 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.5 70.44 0.73 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.348 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.7 mt -45.84 155.52 0.49 Allowed Pre-proline 0 N--CA 1.466 0.356 0 O-C-N 124.161 0.913 . . . . 0.0 111.387 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -35.4 160.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 124.683 3.589 . . . . 0.0 114.888 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 85.3 Cg_exo -49.39 -9.17 0.11 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.338 3.359 . . . . 0.0 114.889 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.32 -35.05 62.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.71 0.232 . . . . 0.0 110.676 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.928 HD23 ' HD2' ' A' ' 84' ' ' LYS . 7.5 tp -107.85 -78.28 0.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -61.32 -48.73 80.01 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.64 -52.73 48.93 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.676 -0.773 . . . . 0.0 114.817 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -72.2 -42.01 66.27 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 95' ' ' LEU . 92.6 mt -65.4 -38.76 90.93 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.675 -179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.6 p -72.15 -29.46 64.06 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.357 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 38' ' ' ASP . . . -85.53 -59.42 2.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.03 -44.44 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 33' ' ' LEU . 89.6 mt -70.81 -19.17 62.7 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.649 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 13.6 t70 -60.99 -37.15 81.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.982 0.42 . . . . 0.0 110.625 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 m -81.22 1.56 31.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 50.3 t -64.16 139.01 58.72 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.316 0.579 . . . . 0.0 111.916 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -129.4 43.67 3.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.358 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 95.26 -13.84 66.16 Favored Glycine 0 CA--C 1.521 0.424 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.791 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.88 97.12 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.762 0.315 . . . . 0.0 111.704 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.61 -17.34 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.113 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 72.49 105.54 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.549 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.476 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 7.8 p90 -51.63 -52.51 47.19 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.361 0.581 . . . . 0.0 110.338 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HB3' HG21 ' A' ' 63' ' ' ILE . 49.1 ptt85 -84.7 -0.32 53.14 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.651 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.41 -39.05 92.34 Favored Glycine 0 N--CA 1.46 0.276 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.87 -178.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.455 HD11 HD13 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -85.15 -45.41 12.08 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.787 0.327 . . . . 0.0 110.713 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.58 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -62.78 -40.49 97.48 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -61.41 -41.16 96.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.011 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -64.47 -40.8 96.38 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.368 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.721 HD23 HD21 ' A' ' 77' ' ' LEU . 56.5 tp -69.17 -44.13 72.86 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.911 0.386 . . . . 0.0 110.609 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.5 m -139.67 125.09 19.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.167 178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.3 m -109.36 111.22 22.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.508 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.8 m -143.1 143.92 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.197 178.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 62.7 p-90 -81.32 -11.26 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.21 -32.33 12.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.645 0.26 . . . . 0.0 111.484 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.53 ' HA ' ' CE1' ' A' ' 62' ' ' HIS . 99.0 m-20 -62.78 -38.65 91.45 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.825 ' HA ' HD12 ' A' ' 63' ' ' ILE . 32.5 m -64.76 -19.79 26.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -64.18 -46.36 84.32 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.695 0.283 . . . . 0.0 110.954 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.53 ' CE1' ' HA ' ' A' ' 59' ' ' ASP . 18.7 p-80 -85.68 -14.71 44.64 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.825 HD12 ' HA ' ' A' ' 60' ' ' VAL . 76.4 mt -59.8 -40.43 82.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 121.406 0.622 . . . . 0.0 109.518 178.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.455 ' O ' HG12 ' A' ' 67' ' ' VAL . 97.6 mt-10 -72.13 -21.33 61.48 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.601 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -73.85 -52.7 12.18 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 18.1 mt-10 -86.85 -3.51 59.08 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.2 p -57.36 -34.31 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.914 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -89.58 -4.52 57.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.07 0.462 . . . . 0.0 110.571 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -107.12 22.75 15.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.717 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 105.11 20.4 9.8 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.302 -0.951 . . . . 0.0 114.037 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 92.79 141.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.364 1.065 . . . . 0.0 112.155 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.575 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.2 t -130.18 -28.64 2.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.037 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.28 -64.49 4.34 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.072 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.453 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -87.68 -36.33 17.48 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.8 ttt180 -61.66 -47.98 82.89 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.622 -178.303 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 13.3 tm-20 -62.55 -40.71 97.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.62 0.248 . . . . 0.0 110.647 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.721 HD21 HD23 ' A' ' 53' ' ' LEU . 63.4 tp -60.55 -46.65 89.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.524 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.4 mt -70.37 -39.11 74.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.89 0.376 . . . . 0.0 111.721 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -78.35 -4.93 50.55 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.9 m -58.12 -40.16 80.54 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -86.54 -90.39 0.11 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.983 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.3 -86.92 0.5 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.6 -56.97 2.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.928 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.54 -43.7 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.2 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 t30 48.03 35.74 5.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.702 0.801 . . . . 0.0 111.605 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.43 171.24 14.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.713 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.3 p -123.78 158.42 31.79 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.221 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.63 -41.28 84.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.268 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -39.8 98.14 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.815 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.47 -45.89 88.72 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.526 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -76.28 -24.88 54.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.456 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 107' ' ' ILE . 62.5 tp -58.96 -41.3 87.17 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.177 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.13 -42.81 99.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.855 0.359 . . . . 0.0 110.956 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 79.5 t -70.52 -43.63 77.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.294 0.569 . . . . 0.0 110.696 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 33' ' ' LEU . 7.1 mp -61.83 -38.62 88.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.199 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -60.09 -39.98 88.02 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -62.77 -44.51 95.99 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.424 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.4 mmm -69.87 -38.89 76.54 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 104.32 42.6 1.87 Allowed Glycine 0 CA--C 1.523 0.55 0 C-N-CA 119.79 -1.195 . . . . 0.0 113.291 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.726 ' HB2' ' HB3' ' A' ' 103' ' ' ALA . 26.8 p-80 -56.78 111.67 1.09 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.181 0.515 . . . . 0.0 112.355 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -85.4 -64.37 1.17 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -65.94 -35.87 81.79 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.043 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.726 ' HB3' ' HB2' ' A' ' 100' ' ' HIS . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.557 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.492 ' O ' HG22 ' A' ' 107' ' ' ILE . 87.1 mt -60.13 -40.54 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 121.205 0.526 . . . . 0.0 109.878 178.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -59.45 -48.34 82.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.561 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.5 -25.46 28.82 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.52 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.629 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 13.1 tt -61.59 -20.71 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 122.166 -0.334 . . . . 0.0 111.315 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.3 p -71.8 -10.15 59.35 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.384 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.93 -27.71 66.0 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 111.051 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.498 ' HE1' HD22 ' A' ' 25' ' ' LEU . 82.2 t80 -85.73 109.42 18.61 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.881 0.372 . . . . 0.0 110.072 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -144.33 22.87 2.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.73 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -149.19 158.96 44.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.577 0.227 . . . . 0.0 110.849 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.55 156.56 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.774 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 88.6 mt -117.07 141.52 48.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.617 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 51.1 m -108.51 112.73 60.67 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.78 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.63 64.59 8.11 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.572 2.181 . . . . 0.0 112.735 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.9 m -90.47 -4.87 56.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.7 mp0 -73.77 140.99 46.28 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -126.25 147.24 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.629 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 60.8 m -126.7 145.72 50.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.432 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.65 145.54 50.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.574 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -65.05 -39.38 93.21 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.387 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -127.56 146.45 50.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.431 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.207 0 CA-C-O 118.167 -1.352 . . . . 0.0 112.306 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.638 0.256 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 57.46 50.51 11.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.597 -0.728 . . . . 0.0 112.129 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -64.23 -39.32 93.71 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.37 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 83.02 4.09 90.14 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.821 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.5 m -62.94 -40.04 96.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.804 0.335 . . . . 0.0 111.519 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.0 ttp -88.1 78.18 8.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.038 0.446 . . . . 0.0 110.499 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.23 -40.96 97.11 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.47 179.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.57 165.45 40.39 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.643 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -159.2 150.8 20.44 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.1 m -122.02 145.63 47.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.769 0.318 . . . . 0.0 111.102 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 176.67 177.74 45.88 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.005 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.41 151.2 24.26 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -116.6 -70.43 0.79 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.743 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.09 156.7 28.82 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.616 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.77 93.02 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -107.63 148.6 29.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.2 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.7 p -80.12 110.62 15.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.098 0.475 . . . . 0.0 111.479 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 -10.04 46.66 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.103 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -104.35 21.74 16.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.564 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.1 m -66.88 114.98 6.14 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.747 0.308 . . . . 0.0 111.771 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.71 174.2 9.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.729 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.84 -57.63 3.56 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -72.24 -35.85 68.94 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.532 0.682 . . . . 0.0 110.808 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -111.85 69.96 0.7 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.243 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -46.34 156.02 0.52 Allowed Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.451 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.53 163.5 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 124.854 3.703 . . . . 0.0 114.635 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.77 -8.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 124.386 3.39 . . . . 0.0 115.027 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.706 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.87 -35.85 64.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.919 0.327 . . . . 0.0 110.532 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.9 tp -108.1 -78.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.55 -47.35 85.94 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -177.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.89 -52.2 49.95 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.692 -0.766 . . . . 0.0 114.988 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.447 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 32.3 tp10 -72.71 -43.7 62.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.11 -40.72 94.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.435 -0.506 . . . . 0.0 112.324 -178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 67.6 m -70.79 -43.84 67.86 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.45 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.75 -50.48 24.23 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.17 -43.38 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.584 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 84.7 mt -78.77 -15.9 57.85 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.626 -179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.4 t70 -58.77 -39.46 81.06 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.148 0.499 . . . . 0.0 110.8 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.5 m -90.53 10.03 27.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.023 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.1 t -68.13 142.43 55.76 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -137.92 57.66 1.71 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.178 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.46 -10.97 73.2 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.554 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.33 98.19 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.255 0.527 . . . . 0.0 111.019 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -126.14 -32.87 2.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.88 115.39 1.83 Allowed Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.625 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.6 p90 -54.38 -46.08 72.97 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.226 0.513 . . . . 0.0 110.846 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.404 ' HB3' HD13 ' A' ' 63' ' ' ILE . 46.9 ptt85 -83.49 -0.09 48.67 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 177.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.73 -47.65 89.19 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.297 -0.954 . . . . 0.0 113.465 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.3 mt -72.15 -42.66 65.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.055 0.427 . . . . 0.0 111.217 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.48 -39.87 92.45 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.19 -44.34 95.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.311 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -65.93 -40.5 91.46 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.026 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 77' ' ' LEU . 0.9 OUTLIER -74.8 -39.96 61.4 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 m -92.2 -169.65 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.016 0.436 . . . . 0.0 111.621 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 88.2 p -135.81 156.05 49.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.201 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t 70.85 164.77 0.28 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 123.792 0.683 . . . . 0.0 111.235 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.515 ' O ' HG22 ' A' ' 60' ' ' VAL . 32.1 m-90 -111.38 8.02 21.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.675 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 97.1 mt -70.79 -28.59 64.76 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.127 0.489 . . . . 0.0 111.175 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -65.25 -20.21 66.32 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.815 ' HA ' HD12 ' A' ' 63' ' ' ILE . 16.1 m -61.35 -20.15 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -60.07 -47.89 83.97 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.585 0.231 . . . . 0.0 111.012 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.7 t60 -73.87 -28.25 61.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.632 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.815 HD12 ' HA ' ' A' ' 60' ' ' VAL . 85.2 mt -59.54 -41.55 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 121.289 0.566 . . . . 0.0 110.32 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.473 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.9 mm-40 -67.09 -34.96 78.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 178.491 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.4 mttt -62.53 -49.21 76.24 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -177.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.2 mt-10 -89.47 -3.64 58.29 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -54.86 -28.7 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 118.116 0.416 . . . . 0.0 111.502 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.68 -4.73 58.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 111.179 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -106.47 22.32 16.0 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.895 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.727 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 12.01 30.72 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-O 118.567 -1.129 . . . . 0.0 113.605 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.727 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.8 tppp? 108.34 149.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.97 1.308 . . . . 0.0 112.227 177.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -134.36 -19.79 1.9 Allowed 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.495 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -60.78 -67.76 1.98 Allowed Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.605 -1.283 . . . . 0.0 111.72 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 m -88.11 -33.85 18.11 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.508 -0.407 . . . . 0.0 111.057 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -61.44 -45.74 93.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.839 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.9 tt0 -61.68 -41.57 97.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.602 0.239 . . . . 0.0 110.477 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -61.76 -46.24 90.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.533 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.5 mt -67.69 -39.23 84.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.872 0.368 . . . . 0.0 111.145 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -80.96 -4.94 56.75 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.2 m -58.45 -40.05 81.58 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -86.26 -89.61 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -86.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.121 0.486 . . . . 0.0 109.745 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -114.29 -54.64 2.57 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 18.5 ttpp -132.26 -43.9 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.6 t30 47.41 34.87 3.57 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.826 0.85 . . . . 0.0 111.703 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.29 170.79 15.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.648 -179.1 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.0 p -122.86 158.6 29.94 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.036 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.456 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -59.39 -38.18 73.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.08 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.57 98.13 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.104 -0.57 . . . . 0.0 112.756 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.22 -46.43 87.03 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.649 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.1 mm? -74.18 -24.13 59.33 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.154 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.6 tp -59.16 -37.66 77.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.061 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.0 -41.69 97.02 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.836 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.65 -23.26 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.183 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.6 mp -63.42 -41.09 98.7 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 109.843 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -65.77 -37.75 87.17 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.558 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -61.65 -40.52 95.2 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.68 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.4 mmt -89.42 -12.97 38.73 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.608 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.83 37.97 65.83 Favored Glycine 0 CA--C 1.52 0.401 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.748 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.474 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 19.3 t-160 -78.05 95.29 4.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.318 0.559 . . . . 0.0 110.218 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.63 -40.86 96.21 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.096 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -61.19 -39.89 91.89 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.688 0.28 . . . . 0.0 111.291 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.521 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -38.78 88.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.397 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.576 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -62.15 -42.95 97.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.953 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -63.38 -40.8 98.22 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.456 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.16 -21.77 31.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.706 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.7 tp -61.72 -21.0 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 120.696 0.284 . . . . 0.0 111.514 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.5 t -67.86 -13.94 62.55 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -74.29 -10.82 59.97 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 111.665 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -66.59 138.67 57.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.033 0.444 . . . . 0.0 111.143 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.33 14.87 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.695 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.96 -39.47 92.23 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.816 0.341 . . . . 0.0 111.666 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 30.3 m -74.56 -17.59 16.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.029 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.7 mt 70.88 -55.71 0.64 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.43 0.692 . . . . 0.0 112.168 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.0 m -120.01 97.38 49.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.537 0.208 . . . . 0.0 111.439 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -72.72 157.01 52.79 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.656 2.237 . . . . 0.0 112.236 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.6 p -64.59 -34.34 78.03 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.826 0.346 . . . . 0.0 111.664 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -119.76 144.71 47.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 57.65 41.53 25.33 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.734 0.646 . . . . 0.0 111.545 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 91.7 p -74.79 162.0 29.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.155 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -120.87 127.98 52.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.594 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -125.82 144.69 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -112.67 126.74 55.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.517 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.972 0 CA-C-O 118.507 -1.163 . . . . 0.0 112.303 -179.951 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.551 0.215 . . . . 0.0 110.815 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 59.0 47.35 12.27 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.11 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -146.52 160.65 41.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.433 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.98 2.39 90.67 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.886 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.2 m -85.85 73.42 10.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.982 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 39.1 mmt -84.52 141.2 30.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.807 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -71.14 139.38 50.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.188 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.95 -175.4 42.55 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.551 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.94 130.87 44.98 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.525 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 74.3 m 65.34 20.34 11.81 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.697 0.623 . . . . 0.0 111.559 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.74 -41.55 98.89 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.346 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.81 156.98 35.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.612 0.244 . . . . 0.0 111.114 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.43 158.47 42.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.518 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.52 164.6 33.28 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.075 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.57 -89.19 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.004 0.522 . . . . 0.0 111.749 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.43 160.65 16.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.591 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 1.7 p -72.64 108.53 5.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.065 0.459 . . . . 0.0 110.586 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.95 -6.5 53.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.996 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.525 ' NE2' ' HA ' ' A' ' 10' ' ' CYS . 79.8 m80 -104.47 21.53 16.55 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.203 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.508 HG23 ' HD3' ' A' ' 26' ' ' PRO . 32.4 m -76.42 122.6 24.75 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.29 166.88 20.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.438 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.449 HD12 ' HB3' ' A' ' 114' ' ' LEU . 68.5 tp -63.66 -49.81 71.76 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.84 -33.73 22.81 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.344 0.593 . . . . 0.0 111.292 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.3 72.47 0.78 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.529 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 114' ' ' LEU . 77.2 mt -46.73 156.83 0.5 Allowed Pre-proline 0 CA--C 1.541 0.599 0 O-C-N 123.415 0.447 . . . . 0.0 111.282 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.3 Cg_exo -37.78 162.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.364 1.342 0 C-N-CA 124.877 3.718 . . . . 0.0 115.126 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 87.7 Cg_exo -49.13 -9.35 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 124.338 3.359 . . . . 0.0 115.11 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.38 -35.02 62.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.825 0.284 . . . . 0.0 110.998 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.824 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.1 tp -108.49 -78.28 0.59 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.66 -48.44 80.79 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.9 -51.74 56.72 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.645 -0.788 . . . . 0.0 114.249 -178.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -70.21 -44.03 69.47 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.403 HD21 HD21 ' A' ' 95' ' ' LEU . 96.2 mt -68.39 -39.0 81.84 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.4 p -71.82 -30.93 66.01 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.689 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.14 -56.76 3.38 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.69 -44.71 96.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.85 -18.04 61.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.607 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.447 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 12.7 t70 -58.41 -38.56 77.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 110.755 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.5 m -90.39 7.72 37.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.095 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.0 t -65.75 140.63 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.229 0.537 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -135.46 54.61 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.145 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.66 -10.58 73.8 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 115.692 -0.685 . . . . 0.0 113.607 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.52 98.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 117.255 0.528 . . . . 0.0 111.007 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -123.4 -26.63 4.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.76 114.86 0.83 Allowed Glycine 0 N--CA 1.444 -0.78 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.755 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.409 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 p90 -53.58 -46.47 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.191 0.495 . . . . 0.0 110.403 178.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.438 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.8 ptt85 -83.75 1.33 43.32 Favored 'General case' 0 C--O 1.213 -0.865 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.797 177.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.9 -44.86 94.22 Favored Glycine 0 C--O 1.23 -0.134 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.252 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.456 HD21 HD23 ' A' ' 95' ' ' LEU . 93.1 mt -72.88 -43.51 62.42 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.036 0.418 . . . . 0.0 111.194 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.763 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.37 -39.55 92.42 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.48 -42.87 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.048 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -41.79 99.35 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.544 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.998 HD23 HD11 ' A' ' 77' ' ' LEU . 52.1 tp -67.76 -40.14 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.604 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.3 m 58.62 50.94 8.34 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.147 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p -63.75 -37.77 88.61 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.735 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.3 t -155.72 146.16 21.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.735 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -70.28 -31.29 68.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.47 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.5 mt -88.28 0.07 56.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.675 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.41 ' O ' HG13 ' A' ' 63' ' ' ILE . 36.8 t70 -61.13 -39.45 90.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.521 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.828 ' HA ' HD12 ' A' ' 63' ' ' ILE . 15.9 m -61.35 -27.92 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.26 -39.71 95.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 0.0 111.24 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 15.0 t60 -84.04 -18.38 37.21 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.24 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.828 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.6 mt -60.41 -41.49 87.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.089 0.471 . . . . 0.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.515 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -64.64 -38.68 91.84 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 33.5 mttm -65.89 -46.15 79.43 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -177.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.98 -3.81 57.8 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.3 p -56.11 -35.59 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-N 118.18 0.446 . . . . 0.0 111.392 -179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.36 -4.62 58.0 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.966 0.412 . . . . 0.0 110.862 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -104.83 22.21 15.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.869 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.54 21.48 9.22 Favored Glycine 0 CA--C 1.52 0.375 0 C-N-CA 120.409 -0.901 . . . . 0.0 114.191 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.31 141.13 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.302 1.041 . . . . 0.0 112.004 177.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.543 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.6 t -130.73 -30.74 1.82 Allowed 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.236 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.54 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.65 -64.33 4.43 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.309 -0.948 . . . . 0.0 112.316 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.486 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 22.8 m -87.74 -38.53 15.71 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 122.725 -0.279 . . . . 0.0 111.692 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.515 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.5 ttt180 -60.54 -48.36 82.13 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.543 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -63.29 -39.68 95.24 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.772 0.32 . . . . 0.0 110.677 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.998 HD11 HD23 ' A' ' 53' ' ' LEU . 56.9 tp -61.08 -46.85 88.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.559 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.447 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 88.2 mt -71.31 -39.13 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.1 0.476 . . . . 0.0 111.19 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -76.25 -7.03 53.99 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -178.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.7 p -57.66 -38.94 75.94 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 m95 -87.62 -89.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.484 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -87.22 0.49 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -115.63 -52.37 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.824 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.5 ttpm? -132.25 -44.75 0.93 Allowed 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.0 t30 47.09 35.85 3.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.503 0.721 . . . . 0.0 111.307 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.32 16.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.986 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 61.9 p -119.27 155.24 32.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.462 HG23 HD11 ' A' ' 107' ' ' ILE . 1.7 mp -59.68 -39.72 80.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.608 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.93 -39.21 97.24 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.743 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.17 -45.84 89.94 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.607 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.68 -23.88 53.19 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.494 HD13 HD13 ' A' ' 107' ' ' ILE . 62.8 tp -59.01 -41.65 88.25 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.037 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.2 -41.25 98.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.606 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.17 -40.25 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.174 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.456 HD23 HD21 ' A' ' 49' ' ' LEU . 81.5 mt -61.62 -36.94 82.19 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.27 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -60.92 -39.68 90.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.854 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -63.44 -44.2 95.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.936 0.398 . . . . 0.0 110.408 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 37.4 mmt -68.87 -36.56 78.25 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.956 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.53 30.17 27.93 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.525 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -74.41 97.33 3.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.147 0.498 . . . . 0.0 110.927 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.33 -41.66 96.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.663 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.8 tpp180 -62.16 -41.33 98.2 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.901 0.381 . . . . 0.0 110.872 -179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.93 -39.11 88.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.24 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 41.2 mm -62.41 -43.67 98.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.794 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -63.55 -42.08 98.41 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -83.93 -22.96 31.35 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.634 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.6 tt -66.09 -20.54 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 120.84 0.353 . . . . 0.0 111.429 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.1 p -70.47 -10.94 60.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.836 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -69.87 -26.33 64.14 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 0.0 110.917 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -68.28 127.54 33.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -159.48 52.26 0.38 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.98 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -146.95 152.97 39.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.593 0.196 . . . . 0.0 110.541 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.5 t -99.64 91.75 2.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.083 0.468 . . . . 0.0 110.538 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.449 ' HB3' HD12 ' A' ' 22' ' ' LEU . 91.6 mt -128.77 135.66 49.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.239 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -127.12 116.08 21.82 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.79 -0.186 . . . . 0.0 110.94 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.04 147.57 54.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.465 2.11 . . . . 0.0 112.123 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.9 m -131.11 144.19 51.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.773 0.321 . . . . 0.0 111.2 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -132.02 148.09 52.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.273 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -114.91 126.14 54.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.751 0.31 . . . . 0.0 110.444 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.2 m -127.16 145.76 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.517 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -68.33 -37.75 80.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.902 0.382 . . . . 0.0 110.985 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -152.28 159.37 43.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.311 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 59.5 -106.13 0.27 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.623 0.577 . . . . 0.0 111.377 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.15 -1.361 . . . . 0.0 112.273 -179.928 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.825 0.345 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 58.01 46.46 16.37 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.995 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -74.01 144.9 44.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.07 -173.39 41.7 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.275 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.8 t -107.32 125.39 51.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.695 0.283 . . . . 0.0 110.47 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.9 mtp -88.33 69.54 9.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.024 0.44 . . . . 0.0 111.009 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.27 149.37 32.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.373 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.32 4.86 90.03 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.625 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -71.1 143.87 50.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.806 0.336 . . . . 0.0 110.806 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.6 p -150.13 165.67 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.54 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.14 91.44 1.65 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.603 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.59 152.01 37.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.322 0.106 . . . . 0.0 110.773 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? 57.19 44.71 21.79 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.653 0.596 . . . . 0.0 111.812 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.71 4.22 72.12 Favored Glycine 0 CA--C 1.52 0.352 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.753 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -162.35 0.85 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.696 0.284 . . . . 0.0 110.999 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.67 159.74 29.41 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.822 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.6 p -73.48 110.0 7.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.897 0.38 . . . . 0.0 111.736 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.19 -7.96 49.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.348 0.594 . . . . 0.0 110.476 178.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -106.89 21.23 17.86 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.356 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 t -70.37 114.14 8.2 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -163.7 175.03 10.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.6 178.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mp -80.31 -57.87 3.4 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -71.51 -36.13 70.97 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.623 0.725 . . . . 0.0 110.589 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -112.42 69.76 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.334 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD13 ' CE1' ' A' ' 110' ' ' TYR . 83.8 mt -47.14 157.46 0.5 Allowed Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.824 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -39.71 165.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 124.86 3.707 . . . . 0.0 114.182 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.85 -9.36 0.15 Allowed 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.932 3.088 . . . . 0.0 114.979 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.495 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.18 -35.29 67.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.773 0.26 . . . . 0.0 110.933 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.887 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.1 tp -107.88 -77.8 0.59 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -49.38 73.73 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -51.79 56.85 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.404 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.5 tm-20 -71.28 -43.49 67.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.496 HD13 HG21 ' A' ' 74' ' ' THR . 83.8 mt -67.86 -38.86 83.62 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -178.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.8 p -74.18 -32.1 62.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.822 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.96 -56.33 3.53 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.43 -45.25 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.8 -17.9 61.53 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.056 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.0 t70 -59.22 -37.79 78.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.979 0.419 . . . . 0.0 110.892 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.6 m -86.98 6.51 31.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.193 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.14 142.03 58.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.206 0.527 . . . . 0.0 111.458 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -131.42 46.19 2.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.155 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.12 -11.79 71.2 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.637 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.16 -43.32 98.6 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.099 0.476 . . . . 0.0 111.059 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -114.67 -24.89 8.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.296 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.76 113.96 0.26 Allowed Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.222 -178.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.5 p90 -53.03 -46.01 68.24 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 117.429 0.614 . . . . 0.0 110.388 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.3 ptt85 -84.01 1.3 44.46 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.012 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.77 -50.87 60.54 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.952 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.436 HD13 HD11 ' A' ' 91' ' ' LEU . 96.5 mt -71.86 -41.87 67.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.281 0.54 . . . . 0.0 111.302 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.16 -41.52 94.6 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -59.92 -44.11 94.51 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.19 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.039 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.468 HD22 HD21 ' A' ' 77' ' ' LEU . 1.3 tt -69.25 -43.83 73.17 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.94 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.4 t -155.87 139.73 16.23 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.752 0.31 . . . . 0.0 110.659 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.6 m -122.16 129.77 52.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.86 0.362 . . . . 0.0 111.272 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -157.29 141.95 16.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.899 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.8 m0 -64.49 -40.41 95.61 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.899 0.38 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.26 -39.57 82.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.055 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.426 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.1 t70 -63.77 -45.97 87.37 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.568 -179.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.824 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.5 m -68.06 -26.59 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -178.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -63.86 -44.12 94.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.886 0.374 . . . . 0.0 110.59 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -73.55 -24.95 60.18 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.287 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.824 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.6 mt -59.19 -40.27 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.198 0.523 . . . . 0.0 110.678 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -69.77 -20.67 63.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.571 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.91 -52.49 8.77 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 3.7 mt-10 -86.48 -3.38 59.0 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.2 p -55.52 -34.81 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 117.947 0.34 . . . . 0.0 111.134 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.14 -4.59 58.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.774 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -105.12 21.94 16.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.614 -178.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.614 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.5 22.79 8.33 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 114.223 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.614 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.93 139.05 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.389 1.076 . . . . 0.0 112.17 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.555 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -131.4 -20.79 2.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.696 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.405 ' H ' ' HD3' ' A' ' 71' ' ' LYS . . . -60.65 -67.57 2.07 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.832 -1.175 . . . . 0.0 111.669 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.496 HG21 HD13 ' A' ' 33' ' ' LEU . 10.7 m -87.78 -35.03 18.09 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 122.612 -0.346 . . . . 0.0 111.573 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.2 ttt180 -60.86 -47.76 84.89 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.496 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.9 tt0 -62.5 -40.51 96.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.689 0.281 . . . . 0.0 110.908 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.468 HD21 HD22 ' A' ' 53' ' ' LEU . 63.3 tp -62.0 -47.15 86.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.834 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.556 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.2 mt -71.05 -39.85 72.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.056 0.455 . . . . 0.0 111.483 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 26.2 t-105 -77.83 -6.89 55.66 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.368 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -58.59 -42.16 87.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 60.1 m95 -85.63 -89.09 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.08 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.93 -86.59 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.176 0.512 . . . . 0.0 109.725 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -113.98 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.887 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.7 ttpp -131.92 -43.97 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.005 175.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.3 t30 48.09 31.48 2.52 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.099 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.453 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.27 169.51 17.64 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.293 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 78.4 p -127.28 160.07 32.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.757 HG23 HD11 ' A' ' 107' ' ' ILE . 4.4 mm -59.44 -38.64 76.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.151 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.18 96.61 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.628 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -66.42 -43.84 84.6 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.819 0.343 . . . . 0.0 111.09 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -74.5 -29.1 61.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.42 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.05 -41.03 82.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.05 -43.19 99.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.976 0.417 . . . . 0.0 110.616 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 84.6 t -70.87 -41.17 77.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.527 0.68 . . . . 0.0 110.227 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 100' ' ' HIS . 61.0 tp -60.82 -40.95 94.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.06 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.95 -39.56 89.97 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.951 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -64.5 -43.29 94.59 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.564 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 54.0 tpp -69.25 -39.99 78.14 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.182 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.48 40.31 23.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.792 -0.718 . . . . 0.0 114.687 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.401 ' HB3' HD11 ' A' ' 95' ' ' LEU . 9.4 t60 -80.92 112.83 18.67 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.631 0.715 . . . . 0.0 110.227 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.9 mmm180 -64.06 -42.44 97.01 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -62.23 -39.67 93.58 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.1 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.46 84.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.528 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.4 mt -61.32 -43.16 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.455 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.476 ' O ' HG22 ' A' ' 108' ' ' THR . 85.6 m-70 -64.84 -39.46 93.6 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.86 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -82.85 -30.42 28.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.529 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.757 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -62.54 -22.67 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 105' ' ' HIS . 6.0 t -68.77 -6.73 28.33 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -89.02 3.2 52.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 111.457 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.582 ' CE1' HD13 ' A' ' 25' ' ' LEU . 79.2 t80 -95.14 120.7 35.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 0.0 109.989 179.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -134.23 32.11 2.69 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.44 -0.886 . . . . 0.0 113.279 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.88 133.02 40.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.962 0.381 . . . . 0.0 111.101 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.9 m -100.95 3.74 10.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.957 0.408 . . . . 0.0 111.493 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.6 mt -112.45 144.2 42.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.4 m -122.59 86.86 49.25 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.738 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -81.58 64.92 8.68 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.83 2.353 . . . . 0.0 113.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 65.1 m -101.01 137.46 39.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.024 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -127.29 155.08 44.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.348 . . . . 0.0 111.258 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.2 pttm -143.39 157.41 44.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.096 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.5 m -130.03 149.65 51.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.926 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -120.04 127.97 53.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.199 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -124.79 144.64 50.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.34 -39.3 93.62 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.451 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.498 -1.168 . . . . 0.0 112.086 179.97 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 121.102 0.477 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -106.6 126.69 52.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.303 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -126.94 150.35 49.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.559 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.29 -176.81 38.97 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.026 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.4 m 72.51 -57.09 0.64 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.341 0.656 . . . . 0.0 111.959 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.1 mtp 55.52 51.37 12.86 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.981 0.419 . . . . 0.0 111.568 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -135.41 153.01 51.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.917 -179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.0 -174.13 42.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.181 -0.533 . . . . 0.0 111.961 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -137.84 145.52 42.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.75 0.275 . . . . 0.0 111.039 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.6 t -69.04 129.75 40.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 162.54 21.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.429 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.44 154.69 42.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.558 0.218 . . . . 0.0 110.587 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -120.27 130.36 54.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.892 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.11 158.14 39.9 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.91 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.92 95.77 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 111.908 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.24 145.35 25.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.515 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 p -79.63 108.44 13.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.962 0.41 . . . . 0.0 111.409 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.73 -11.81 32.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.447 0.641 . . . . 0.0 110.972 178.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -105.34 21.7 16.71 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.481 -178.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.3 t -81.9 119.27 23.72 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.47 172.02 19.09 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.4 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.6 tp -63.22 -50.34 70.63 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -178.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -91.48 -35.5 14.29 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.449 0.642 . . . . 0.0 110.904 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.79 71.0 1.04 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.082 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.449 HD13 ' CE1' ' A' ' 110' ' ' TYR . 93.6 mt -47.57 156.33 0.67 Allowed Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.717 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -39.33 165.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 125.068 3.846 . . . . 0.0 114.716 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.26 -8.78 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.296 3.331 . . . . 0.0 115.347 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.29 -36.4 66.12 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.118 0.417 . . . . 0.0 110.456 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.917 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -107.76 -77.93 0.59 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -52.55 65.0 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -49.45 78.41 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.684 -0.77 . . . . 0.0 114.683 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -70.94 -44.22 66.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD13 HG21 ' A' ' 74' ' ' THR . 95.7 mt -68.47 -38.89 81.48 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.649 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -74.08 -32.13 63.13 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.889 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.91 -55.25 4.05 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 66.3 t -64.51 -45.21 96.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.74 HD11 HD12 ' A' ' 49' ' ' LEU . 88.6 mt -72.75 -19.18 61.42 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.926 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.649 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 42.9 t0 -60.31 -36.12 77.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.0 m -86.11 5.76 32.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.183 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.46 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.4 t -65.36 142.19 58.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.399 0.619 . . . . 0.0 111.926 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -130.88 40.32 3.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.582 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 96.12 -15.46 62.92 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.023 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.18 97.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.931 0.365 . . . . 0.0 111.749 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.535 ' HG ' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -108.47 -22.99 12.06 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.173 0.511 . . . . 0.0 109.997 179.142 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.46 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.95 107.61 0.15 Allowed Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.25 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.2 p90 -52.71 -48.47 66.59 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.312 0.556 . . . . 0.0 110.31 178.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -84.17 0.01 50.35 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.599 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.44 -41.76 95.45 Favored Glycine 0 C--N 1.329 0.164 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.45 -177.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.74 HD12 HD11 ' A' ' 37' ' ' LEU . 92.7 mt -84.05 -43.02 15.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.04 0.42 . . . . 0.0 111.186 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.96 94.6 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.591 0.959 . . . . 0.0 113.591 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -60.58 -43.7 97.05 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.147 0.279 . . . . 0.0 111.302 -178.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -65.39 -39.37 92.14 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.588 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.717 HD22 HD21 ' A' ' 77' ' ' LEU . 1.4 tt -69.34 -45.66 68.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.762 0.315 . . . . 0.0 110.979 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.1 m -142.45 132.55 24.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.013 179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.6 m -114.84 122.4 46.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.9 m -136.68 148.75 47.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.092 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.475 ' CD1' ' HG ' ' A' ' 58' ' ' LEU . 69.2 t-105 -95.48 140.0 30.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.535 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HG ' ' CD1' ' A' ' 57' ' ' TRP . 81.5 mt 75.99 -30.1 0.19 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.718 0.807 . . . . 0.0 112.361 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -66.58 -21.19 66.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.706 0.289 . . . . 0.0 111.235 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.493 ' HA ' HD12 ' A' ' 63' ' ' ILE . 25.4 m -63.07 -20.18 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.777 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.13 -41.21 99.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.616 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -66.65 -26.7 67.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.917 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.533 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.53 -41.87 86.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.342 0.592 . . . . 0.0 109.914 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.492 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.38 -34.79 75.08 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.42 178.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.12 -47.7 83.44 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.596 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 61.8 mm-40 -89.36 -3.38 58.48 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -55.77 -33.59 34.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.294 0.497 . . . . 0.0 111.268 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.61 -4.61 57.74 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.899 0.38 . . . . 0.0 110.721 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -108.53 22.82 15.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.196 -178.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.636 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.74 16.04 18.65 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.169 -1.015 . . . . 0.0 114.734 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.636 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 97.83 143.73 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.491 1.116 . . . . 0.0 111.975 177.26 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.2 t -132.09 -27.81 1.79 Allowed 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.495 178.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.34 2.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 119.962 -1.113 . . . . 0.0 112.204 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 33' ' ' LEU . 21.8 m -87.24 -35.96 18.21 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.774 -0.251 . . . . 0.0 111.535 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -60.57 -46.73 89.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.874 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.52 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.4 tt0 -62.08 -42.81 99.59 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.476 0.179 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.717 HD21 HD22 ' A' ' 53' ' ' LEU . 64.3 tp -61.57 -46.42 89.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.463 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.642 HD22 ' HG3' ' A' ' 84' ' ' LYS . 98.3 mt -67.33 -39.54 85.83 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.486 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -80.26 -5.54 56.39 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.5 m -59.07 -40.01 83.87 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -86.4 -90.61 0.11 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.18 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.33 -87.28 0.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 109.717 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -110.47 -56.91 2.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.917 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.4 ttpp -132.5 -43.36 0.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.206 176.446 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 48.51 34.32 4.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.891 0.876 . . . . 0.0 111.883 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.489 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.22 169.3 18.03 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.2 p -125.28 158.62 33.69 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.717 179.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.87 -40.06 81.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.792 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.5 -40.17 98.32 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.733 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.27 -40.79 96.7 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.634 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.259 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.16 -40.1 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.113 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -61.7 -41.35 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.906 0.384 . . . . 0.0 110.482 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.2 t -69.32 -41.17 80.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.282 0.563 . . . . 0.0 110.022 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -59.06 -36.85 75.74 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.704 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.84 -39.35 94.12 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.353 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -61.9 -47.37 85.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.65 0.262 . . . . 0.0 110.657 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.2 mmm -71.21 -36.22 71.79 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.36 33.06 36.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.331 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.535 ' NE2' ' HG ' ' A' ' 44' ' ' LEU . 32.9 t-80 -66.8 108.25 2.46 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.524 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -63.75 -44.74 92.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -64.39 -41.4 96.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.006 0.432 . . . . 0.0 111.044 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.518 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.91 -40.3 92.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.806 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.6 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -62.72 -45.1 99.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.99 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -65.96 -40.54 91.38 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -83.03 -22.37 33.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.6 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.9 tp -66.41 -20.79 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.753 0.311 . . . . 0.0 111.161 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.3 p -70.5 -10.25 58.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.934 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -69.92 -26.24 64.05 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.865 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.449 ' CE1' HD13 ' A' ' 25' ' ' LEU . 82.1 t80 -70.78 129.22 38.53 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.266 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -72.2 146.06 38.78 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.192 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.434 ' O ' ' HB ' ' A' ' 113' ' ' VAL . . . -95.01 156.48 16.3 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.021 -0.105 . . . . 0.0 110.973 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.454 HG12 ' HG ' ' A' ' 114' ' ' LEU . 88.5 t 76.42 139.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 123.887 0.742 . . . . 0.0 111.116 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.454 ' HG ' HG12 ' A' ' 113' ' ' VAL . 87.5 mt 64.38 39.98 6.74 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.208 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.7 m -72.06 133.35 83.83 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.64 61.54 6.17 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.788 2.325 . . . . 0.0 113.163 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 97.1 p -82.97 -11.28 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.739 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -128.33 156.34 43.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -65.79 -20.48 66.27 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.595 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 68.6 m -61.49 -38.11 86.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.337 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -71.89 141.11 49.54 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -150.02 160.16 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 59.94 -111.17 0.5 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.662 0.601 . . . . 0.0 111.253 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.149 -1.362 . . . . 0.0 112.195 -179.952 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 120.912 0.387 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -118.55 134.27 55.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -63.59 -45.89 88.32 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 166.22 38.0 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.956 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.5 ' HA ' HH11 ' A' ' 101' ' ' ARG . 62.3 m -132.74 103.95 6.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.602 0.239 . . . . 0.0 110.958 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.4 mmt -134.56 152.86 52.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.772 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.53 136.56 54.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.748 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 177.55 -179.49 48.19 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.01 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -133.81 103.92 6.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.816 0.341 . . . . 0.0 110.923 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.0 m -130.93 157.83 41.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.347 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.72 143.85 15.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.807 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.4 148.34 43.43 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.501 0.191 . . . . 0.0 111.16 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.418 ' H ' ' HG3' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -70.88 -24.91 62.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.57 178.1 48.5 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.88 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -98.38 -36.69 9.89 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.4 mt -102.68 138.99 38.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.431 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 2.8 p -80.82 108.64 14.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.237 0.541 . . . . 0.0 112.229 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.16 -9.82 41.05 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.884 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -102.77 21.72 14.99 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.889 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -72.1 121.0 18.51 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.19 160.35 11.61 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 114' ' ' LEU . 65.0 tp -65.85 -51.03 62.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -76.09 -36.73 58.82 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.457 0.646 . . . . 0.0 111.242 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.88 70.9 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.836 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -45.43 154.43 0.51 Allowed Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 123.869 0.731 . . . . 0.0 111.848 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -38.04 163.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 125.12 3.88 . . . . 0.0 115.075 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 85.1 Cg_exo -48.76 -9.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.415 3.41 . . . . 0.0 115.177 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.777 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -53.86 -35.29 61.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.784 0.265 . . . . 0.0 110.5 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.83 HD23 ' HD2' ' A' ' 84' ' ' LYS . 3.0 tp -108.03 -77.3 0.6 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.197 0.444 . . . . 0.0 112.197 178.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -53.98 51.54 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.68 -51.75 57.12 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.63 -0.795 . . . . 0.0 115.045 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.5 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 35.8 tp10 -71.3 -43.06 67.82 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.44 -39.32 85.38 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.631 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.4 p -71.46 -29.2 64.58 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.474 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.55 -55.8 3.82 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.406 HG21 ' HG2' ' A' ' 102' ' ' ARG . 54.8 t -64.14 -44.93 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.527 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 88.6 mt -77.56 -16.8 58.42 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 122.068 -0.395 . . . . 0.0 111.846 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.631 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 32.5 t70 -59.34 -39.59 83.65 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.134 0.493 . . . . 0.0 110.556 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -93.27 11.42 28.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.003 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 t -67.86 144.68 55.19 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.015 0.436 . . . . 0.0 111.199 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -136.59 54.89 1.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.92 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.07 -12.94 68.85 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.035 -0.602 . . . . 0.0 114.095 178.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.99 98.75 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.564 0.682 . . . . 0.0 110.894 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -125.38 -30.63 3.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.569 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.5 117.3 0.74 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.237 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.451 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 27.6 p90 -56.24 -42.81 77.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 117.043 0.421 . . . . 0.0 110.743 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.604 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.27 -0.35 52.01 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.671 178.193 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.87 -45.65 94.72 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.548 -0.834 . . . . 0.0 113.235 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.5 mt -72.21 -43.32 64.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.887 0.343 . . . . 0.0 111.262 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.772 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.4 -41.64 93.45 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -61.71 -43.79 98.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.305 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -65.09 -40.33 94.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.715 ' O ' ' HB2' ' A' ' 54' ' ' SER . 59.7 tp -66.81 -47.13 72.99 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.447 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.715 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 0.1 OUTLIER 149.22 93.34 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.452 1.095 . . . . 0.0 110.714 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.0 p -84.37 -12.57 54.28 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.816 0.341 . . . . 0.0 110.98 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.8 m 61.19 16.14 6.97 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.155 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 17.2 m-90 53.73 24.78 4.56 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.12 0.568 . . . . 0.0 112.335 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.4 tp -128.57 -42.67 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.122 0.487 . . . . 0.0 110.476 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -65.93 -20.45 66.22 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.615 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.829 ' HA ' HD12 ' A' ' 63' ' ' ILE . 16.4 m -58.26 -31.1 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.57 -40.85 98.02 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.927 0.394 . . . . 0.0 110.329 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -76.29 -24.07 54.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.719 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.829 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.0 mt -59.85 -43.6 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.124 0.488 . . . . 0.0 110.294 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -67.39 -36.24 80.9 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.931 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.85 -49.06 76.38 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.9 mt-10 -90.08 -4.17 57.51 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.521 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.2 p -56.44 -33.71 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.364 0.529 . . . . 0.0 111.226 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.38 -4.25 58.12 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 110.803 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -106.97 22.13 16.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.026 -178.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.665 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.41 20.94 9.7 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.275 -0.964 . . . . 0.0 114.124 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.665 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.2 tppp? 95.72 147.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.447 1.099 . . . . 0.0 112.082 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.5 t -138.29 -30.91 0.77 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.54 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -52.88 -66.95 2.36 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.279 -0.963 . . . . 0.0 112.708 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.3 m -87.8 -34.45 18.28 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 122.441 -0.447 . . . . 0.0 111.113 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -60.9 -48.37 82.12 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.812 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.0 tt0 -63.15 -41.19 99.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.641 0.258 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.772 HD22 ' HA ' ' A' ' 50' ' ' ALA . 62.2 tp -60.89 -47.23 87.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.6 mt -70.34 -38.51 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.113 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -76.64 -6.62 52.83 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 64.6 m -58.87 -40.29 83.92 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -86.5 -90.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.786 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.26 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.41 -55.98 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.83 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.2 ttpm? -132.31 -43.75 0.94 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.1 t30 47.76 36.02 5.3 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.752 0.821 . . . . 0.0 111.269 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.0 170.85 15.23 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.802 -178.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.5 p -117.99 155.38 30.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.037 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.14 -39.3 78.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.873 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.8 -39.02 97.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.027 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -62.26 -46.63 87.95 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.604 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -75.98 -23.88 55.35 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.178 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.21 -39.46 82.72 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.027 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 53.3 mt-30 -61.22 -42.16 98.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.04 0.448 . . . . 0.0 110.47 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 99.7 t -71.75 -40.15 69.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.391 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 86.2 mt -61.64 -41.08 97.01 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.209 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 16.6 pt20 -68.67 -28.14 66.61 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.41 -48.83 73.89 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 88.7 mmm -71.76 -36.72 70.47 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.437 178.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.48 40.41 3.43 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.947 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -73.87 88.57 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.987 0.422 . . . . 0.0 111.578 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.5 HH11 ' HA ' ' A' ' 5' ' ' SER . 19.4 mmt85 -62.76 -43.25 99.28 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HG2' HG21 ' A' ' 36' ' ' VAL . 7.3 tpm_? -63.22 -40.01 96.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.819 0.342 . . . . 0.0 111.106 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.78 -38.27 87.42 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.602 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.591 ' O ' HG22 ' A' ' 107' ' ' ILE . 94.6 mt -61.39 -44.29 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -65.08 -40.78 95.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.581 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.5 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -81.07 -22.39 39.26 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.502 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.777 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.5 tp -63.18 -20.97 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.863 0.363 . . . . 0.0 111.08 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.8 p -73.02 -13.18 61.17 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.621 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -74.33 -10.03 59.18 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.628 ' HE1' HD22 ' A' ' 25' ' ' LEU . 87.9 t80 -63.12 129.26 39.56 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.89 135.21 15.71 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.932 -179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -85.69 -3.29 58.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.689 0.28 . . . . 0.0 111.532 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.09 -45.56 98.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 22' ' ' LEU . 61.9 tp -123.49 114.16 19.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.314 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.0 m -131.52 125.3 20.57 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.025 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.31 156.76 54.55 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.639 2.226 . . . . 0.0 111.812 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.6 m -64.15 116.87 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.879 0.371 . . . . 0.0 110.89 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -136.6 155.59 49.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.73 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -95.27 167.4 11.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.99 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 62.6 m -67.18 128.58 36.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.253 . . . . 0.0 110.576 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -111.61 7.95 20.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.728 0.299 . . . . 0.0 111.345 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -128.71 149.96 50.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.688 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.7 -39.4 93.6 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.152 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.531 -1.149 . . . . 0.0 112.227 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 120.59 0.233 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 57.21 43.72 23.34 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.372 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -99.14 141.5 31.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.073 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.47 ' HA3' ' HE1' ' A' ' 46' ' ' TRP . . . 177.24 -176.47 48.07 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.322 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.484 ' HB2' HG11 ' A' ' 67' ' ' VAL . 52.7 m -124.61 147.17 48.66 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.0 mtp -87.26 71.61 10.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.71 153.89 33.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 150.43 144.1 3.86 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.407 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -152.5 113.88 4.27 Favored 'General case' 0 N--CA 1.462 0.157 0 O-C-N 122.868 -0.195 . . . . 0.0 110.747 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.0 t -156.99 151.0 24.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.394 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.32 162.06 54.47 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.52 -3.89 59.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 66.39 -121.4 0.3 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.679 0.392 . . . . 0.0 111.194 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.49 8.34 77.59 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.722 -0.751 . . . . 0.0 113.004 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -103.09 -164.23 1.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.621 0.248 . . . . 0.0 111.186 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.1 tp -61.85 135.81 57.73 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.224 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -71.09 106.83 3.87 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.235 0.541 . . . . 0.0 112.141 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.31 -9.8 37.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.712 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -99.86 21.5 12.49 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.178 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.457 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.5 m -78.68 113.38 16.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.387 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' THR . 26.8 mt -154.8 170.61 21.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.76 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.3 tp -63.24 -50.46 70.11 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -92.01 -35.99 13.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.09 0.471 . . . . 0.0 111.583 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.65 70.78 0.88 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.1 mt -45.09 158.84 0.28 Allowed Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.923 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' HG23 ' A' ' 20' ' ' THR . 2.4 Cg_endo -39.96 165.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 124.67 3.58 . . . . 0.0 114.546 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -48.88 -8.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.038 3.159 . . . . 0.0 114.919 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.49 -36.82 67.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 117.867 0.303 . . . . 0.0 110.273 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.963 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.1 tp -107.8 -78.27 0.59 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tt -60.32 -48.54 81.29 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.96 -51.09 59.47 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.331 -0.938 . . . . 0.0 114.436 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.05 -43.3 68.1 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.3 mt -67.36 -37.95 84.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -75.0 -31.97 61.54 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.652 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.51 -58.46 2.66 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.32 -44.8 99.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.467 HD21 ' CD2' ' A' ' 100' ' ' HIS . 76.1 mt -71.91 -19.55 61.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.528 -178.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 28.2 t0 -61.7 -38.28 87.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.123 0.487 . . . . 0.0 110.591 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.3 p -87.35 1.68 52.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.012 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.9 t -66.89 142.55 57.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.267 0.556 . . . . 0.0 111.634 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -131.51 50.07 2.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.468 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.8 -12.78 68.78 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.821 -0.627 . . . . 0.0 113.65 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.44 98.68 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.159 0.504 . . . . 0.0 111.097 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.1 mt -116.16 -29.41 6.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.51 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.81 107.9 0.55 Allowed Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.241 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.547 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 33.1 p90 -53.81 -44.99 70.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.988 0.394 . . . . 0.0 110.671 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.625 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -85.31 -0.51 54.98 Favored 'General case' 0 C--O 1.219 -0.541 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 178.277 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.98 -47.36 91.1 Favored Glycine 0 C--N 1.329 0.166 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.076 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HG21 ' A' ' 74' ' ' THR . 88.8 mt -72.55 -42.13 65.0 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.858 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.31 -42.54 99.03 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.12 -42.04 99.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.092 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.94 -42.01 77.28 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.98 179.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.7 mt -65.62 -40.34 92.47 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.135 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 t 66.17 114.18 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.903 0.752 . . . . 0.0 112.533 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.465 ' OG ' ' HB2' ' A' ' 59' ' ' ASP . 96.0 p -91.42 -3.58 56.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.194 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 56.5 m 59.05 38.01 24.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.342 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -159.52 -177.9 6.74 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.773 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 87.6 mt -78.08 62.92 2.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.116 0.484 . . . . 0.0 110.607 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.465 ' HB2' ' OG ' ' A' ' 55' ' ' SER . 31.8 t0 -63.07 -38.15 90.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.733 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.781 ' HA ' HD12 ' A' ' 63' ' ' ILE . 29.6 m -59.72 -25.56 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.79 -44.52 95.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.153 0.502 . . . . 0.0 109.777 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -80.16 -23.85 40.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.283 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.3 mt -57.96 -44.57 87.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-O 120.616 0.246 . . . . 0.0 111.019 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.527 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -67.36 -37.34 83.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.132 0.491 . . . . 0.0 110.838 178.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.42 -50.27 68.23 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.593 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 52.5 mm-40 -89.75 -5.34 57.07 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.527 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.5 p -57.93 -32.79 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-N 118.266 0.485 . . . . 0.0 111.065 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.8 -4.93 58.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.866 0.365 . . . . 0.0 110.516 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -104.78 21.41 16.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.781 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.8 11.18 33.28 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-O 118.407 -1.218 . . . . 0.0 114.976 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.5 OUTLIER 112.17 141.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.047 1.339 . . . . 0.0 111.624 177.34 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.8 t -128.54 -35.7 1.92 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.797 178.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -49.43 -62.11 5.01 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.847 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.514 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -89.55 -43.06 11.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.531 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 75.8 ttt180 -61.77 -47.63 84.29 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' A' ' 72' ' ' SER . 50.3 tp10 -61.88 -43.67 98.38 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.3 -0.16 . . . . 0.0 111.308 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.78 -44.12 94.32 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.599 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.3 mt -64.62 -39.67 94.13 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.928 0.394 . . . . 0.0 111.057 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -82.13 -6.36 59.13 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.7 m -59.77 -39.48 85.01 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -85.79 -90.67 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.39 -86.33 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.346 0.593 . . . . 0.0 110.018 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -113.25 -57.07 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.963 ' HD2' HD23 ' A' ' 29' ' ' LEU . 14.9 ttpp -132.12 -42.59 0.98 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.6 t30 49.1 33.62 5.01 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.652 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.519 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.65 167.8 21.28 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.5 p -127.23 158.86 36.03 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.67 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.19 -41.95 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.373 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -40.21 98.6 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.72 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.24 -45.62 87.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.771 0.32 . . . . 0.0 111.762 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.617 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.1 -24.69 55.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.63 -179.653 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' A' ' 95' ' ' LEU . 61.7 tp -59.15 -41.36 88.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.349 -179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.39 -41.59 98.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.138 0.495 . . . . 0.0 110.427 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.405 HG12 ' CD2' ' A' ' 49' ' ' LEU . 85.5 t -70.42 -39.86 76.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.416 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 90.6 mt -61.13 -40.26 93.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.608 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.93 -40.34 96.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.942 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.16 -48.03 81.88 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.38 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -71.11 -37.64 72.36 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.8 40.07 2.99 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.206 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.467 ' CD2' HD21 ' A' ' 37' ' ' LEU . 37.4 m80 -78.32 83.41 4.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -63.31 -41.46 98.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.144 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.3 tpp180 -63.53 -40.92 98.29 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 110.755 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.56 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.11 -39.23 89.2 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.484 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.596 ' O ' HG22 ' A' ' 107' ' ' ILE . 43.1 mm -62.58 -43.63 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.402 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -61.1 -48.2 82.76 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.788 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 mp -80.39 -21.26 42.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -62.53 -21.23 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-O 120.871 0.367 . . . . 0.0 111.082 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.1 m -62.78 -14.46 45.38 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.772 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.65 -26.26 64.31 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.551 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -71.95 127.54 32.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.276 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.21 62.3 0.28 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.658 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -146.88 152.08 38.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.619 0.247 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 45.1 t -95.01 94.95 4.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.192 0.52 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 90.8 mt -131.92 157.12 44.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.8 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.9 m -128.91 68.42 79.41 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.857 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.77 154.62 73.88 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.096 2.531 . . . . 0.0 112.1 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.5 m -61.92 142.91 57.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.491 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -124.14 135.33 53.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.679 0.276 . . . . 0.0 111.166 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.1 131.58 50.8 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.267 179.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 54.2 m -136.95 139.94 41.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.683 -0.235 . . . . 0.0 110.615 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.7 -52.69 1.57 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.881 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLN . . . . . 0.489 ' HB3' ' H ' ' A' ' 123' ' ' GLU . 12.1 mp0 56.85 -152.61 0.39 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.26 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.489 ' H ' ' HB3' ' A' ' 122' ' ' GLN . 97.5 mt-10 -64.06 -38.9 92.75 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.931 0.396 . . . . 0.0 111.163 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.155 0 CA-C-O 118.36 -1.245 . . . . 0.0 112.141 179.934 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.991 0.424 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -149.8 160.07 43.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.661 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -126.16 147.03 49.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.51 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.79 179.52 47.73 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.3 m -128.74 150.28 50.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.651 0.262 . . . . 0.0 110.639 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.9 mtt -115.59 140.63 48.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.508 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.48 -139.91 0.77 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.648 0.593 . . . . 0.0 111.321 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.11 1.73 90.55 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.78 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -155.43 165.86 35.32 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.9 p -77.99 159.32 28.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.883 0.373 . . . . 0.0 110.988 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -93.02 -167.9 39.04 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.623 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -39.47 92.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.458 0.17 . . . . 0.0 111.458 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 58.72 40.19 23.48 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.531 0.519 . . . . 0.0 111.549 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -149.4 -133.06 2.15 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.18 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.92 90.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.685 0.279 . . . . 0.0 111.622 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.51 138.82 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.017 0.437 . . . . 0.0 111.071 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 p -101.63 111.32 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.854 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.21 -8.72 52.99 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.036 0.446 . . . . 0.0 111.449 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -104.31 21.68 16.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.139 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.6 m -69.13 119.73 13.87 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.62 176.52 7.19 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.454 178.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.94 -58.03 3.36 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -72.66 -35.69 67.77 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.536 0.684 . . . . 0.0 110.813 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -112.25 70.56 0.72 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.849 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.479 HD22 ' HE1' ' A' ' 110' ' ' TYR . 98.5 mt -48.09 158.03 0.6 Allowed Pre-proline 0 CA--C 1.538 0.486 0 O-C-N 123.802 0.689 . . . . 0.0 111.589 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -38.77 165.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 124.987 3.792 . . . . 0.0 114.622 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -50.29 -9.34 0.17 Allowed 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 123.874 3.049 . . . . 0.0 114.812 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.19 -36.15 68.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.575 0.171 . . . . 0.0 110.546 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.937 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.4 tp -108.25 -78.93 0.58 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.17 -0.612 . . . . 0.0 112.562 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.34 -48.6 80.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.8 -52.35 53.5 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.525 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -72.37 -43.4 64.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 74' ' ' THR . 96.0 mt -67.5 -38.55 84.49 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -77.09 -33.0 57.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.101 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.57 -56.8 3.33 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.456 HG11 ' HG2' ' A' ' 102' ' ' ARG . 63.1 t -64.25 -45.07 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -177.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.628 HD13 HD11 ' A' ' 49' ' ' LEU . 53.0 mt -73.45 -17.62 61.22 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.152 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.6 t70 -59.41 -37.09 77.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 0.0 110.671 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.6 p -84.85 4.58 32.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.405 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 53.9 t -61.91 141.33 58.06 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.329 0.585 . . . . 0.0 112.005 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -132.36 45.94 2.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.89 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.86 -12.01 70.03 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.282 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.67 98.67 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.451 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.14 -23.49 8.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.018 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.405 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.73 109.86 0.25 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.957 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -53.06 -47.89 68.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.168 0.484 . . . . 0.0 110.532 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.34 2.3 36.94 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.02 -37.41 71.07 Favored Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.03 -177.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.628 HD11 HD13 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -82.19 -45.22 15.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.65 0.262 . . . . 0.0 110.832 179.503 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -61.84 -38.07 86.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.717 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.78 -43.4 94.39 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.157 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -39.23 93.8 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.187 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.574 HD22 HD11 ' A' ' 77' ' ' LEU . 4.4 tt -65.83 -37.85 87.34 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m 64.3 68.28 0.56 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.327 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.6 m -66.4 154.64 39.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.8 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 m -67.61 151.99 46.38 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.861 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 97.4 m95 68.07 -161.59 0.21 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.648 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -99.19 72.07 1.84 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.07 0.462 . . . . 0.0 111.041 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -70.59 -19.26 62.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.307 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.796 ' HA ' HD12 ' A' ' 63' ' ' ILE . 15.8 m -61.22 -30.66 48.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.5 -40.99 98.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.041 0.448 . . . . 0.0 110.211 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -74.39 -25.99 59.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.661 179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 60' ' ' VAL . 83.1 mt -59.81 -43.71 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 109.975 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.8 mt-10 -67.85 -36.15 79.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.135 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.81 -49.07 76.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.99 -4.04 57.66 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -56.67 -33.9 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 118.239 0.472 . . . . 0.0 111.12 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.54 -4.24 57.98 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.847 0.356 . . . . 0.0 110.733 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -106.15 21.99 16.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.015 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.568 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.29 21.74 9.18 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.269 -0.967 . . . . 0.0 114.281 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 94.37 141.83 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.36 1.064 . . . . 0.0 112.175 177.342 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.553 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.3 t -132.31 -29.9 1.56 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.078 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.582 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.58 -54.15 40.15 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 119.865 -1.159 . . . . 0.0 112.269 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.658 HG21 ' HB3' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -91.5 -43.4 9.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.149 0.499 . . . . 0.0 111.872 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.534 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.4 ttt180 -60.13 -47.58 85.33 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.548 -177.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.7 tt0 -62.59 -41.13 98.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.754 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.658 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.19 -46.59 89.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.686 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.573 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.5 mt -71.61 -38.95 70.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.148 0.499 . . . . 0.0 111.014 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -75.32 -6.26 48.97 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -58.24 -40.35 81.5 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -86.77 -89.96 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.792 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -112.36 -55.79 2.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.937 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.74 -44.58 0.89 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.604 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.3 t30 47.66 35.87 4.94 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.941 178.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 167.9 21.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.8 p -117.51 157.58 26.04 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.396 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.42 -39.44 79.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.431 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.47 99.27 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 120.902 -0.665 . . . . 0.0 112.981 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.04 -40.84 97.21 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.624 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.79 -24.34 36.0 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.128 -179.715 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.66 -41.94 91.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.14 -41.33 98.15 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.445 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -66.73 -41.85 88.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.216 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 93.2 mt -61.62 -40.88 96.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.844 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -65.03 -39.59 93.57 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.527 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -61.81 -48.83 78.84 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.44 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 15.3 tpt -72.53 -39.82 67.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.8 40.35 2.02 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.987 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.475 ' O ' HG12 ' A' ' 104' ' ' ILE . 77.4 m80 -78.38 87.68 4.4 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.718 0.294 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.64 -42.85 99.83 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ARG . . . . . 0.456 ' HG2' HG11 ' A' ' 36' ' ' VAL . 25.4 tpp180 -63.45 -41.08 98.64 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.125 0.488 . . . . 0.0 110.913 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.415 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.09 -38.12 85.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.646 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 40.3 mm -61.29 -44.19 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.674 179.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -64.7 -41.21 96.17 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.621 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -79.35 -23.04 43.65 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.47 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.2 tp -63.87 -21.14 28.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.92 0.391 . . . . 0.0 111.425 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -75.48 -9.46 58.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.75 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -89.21 5.05 46.54 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.479 ' HE1' HD22 ' A' ' 25' ' ' LEU . 60.2 t80 -60.4 -49.17 78.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.63 0.252 . . . . 0.0 111.141 178.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 156.02 179.11 30.83 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.537 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.05 2.98 52.02 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.364 . . . . 0.0 111.336 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 25.1 m -126.16 157.48 36.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.192 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.61 -40.11 94.91 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.26 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.7 m -132.67 148.21 68.64 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.794 -0.184 . . . . 0.0 111.107 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -78.05 68.22 7.88 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.742 2.295 . . . . 0.0 112.788 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 63.5 m -106.33 137.61 43.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.628 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -127.37 148.52 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.592 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -74.2 143.74 45.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.797 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.6 m -122.95 146.06 47.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -106.11 71.89 0.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.64 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 58.9 -93.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.466 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -90.43 -9.85 45.98 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.706 0.288 . . . . 0.0 111.369 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.569 -179.87 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.598 0.237 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 57.75 53.37 7.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.035 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -63.97 -39.43 94.12 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.726 0.298 . . . . 0.0 111.28 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.99 -55.64 3.68 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.497 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.2 m 59.92 41.44 17.73 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.848 0.459 . . . . 0.0 111.875 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.5 mmt -120.53 135.1 55.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.582 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.72 155.25 39.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.911 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -172.57 175.96 45.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.058 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 57.0 t30 55.15 44.23 28.16 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.103 0.478 . . . . 0.0 111.253 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -118.87 147.66 43.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.68 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 91.6 -8.29 78.86 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.753 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.64 45.83 0.97 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.726 0.298 . . . . 0.0 111.15 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.9 ttp-105 -61.7 -46.38 89.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.825 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.07 153.3 27.25 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 121.016 -0.612 . . . . 0.0 113.457 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.43 94.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.155 0.503 . . . . 0.0 110.857 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.89 149.33 21.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.624 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.533 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 0.8 OUTLIER -72.29 107.55 4.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.268 0.556 . . . . 0.0 111.605 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.67 -8.56 43.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.125 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.51 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 79.7 m80 -103.33 21.05 16.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.69 -178.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.591 HG23 ' HD3' ' A' ' 26' ' ' PRO . 77.7 m -77.74 120.07 22.13 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.59 170.51 21.33 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.029 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.6 -50.4 69.56 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -91.53 -35.0 14.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.363 0.602 . . . . 0.0 111.319 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.57 71.58 1.09 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.879 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.9 mt -44.7 156.95 0.33 Allowed Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.935 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.591 ' HD3' HG23 ' A' ' 20' ' ' THR . 4.1 Cg_exo -39.33 164.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 124.999 3.799 . . . . 0.0 114.488 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.533 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 9.6 Cg_endo -54.65 -7.72 0.98 Allowed 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.643 2.895 . . . . 0.0 113.973 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.43 -35.53 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.734 HD23 ' HD3' ' A' ' 84' ' ' LYS . 2.9 tp -105.7 -78.07 0.58 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.044 178.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.431 ' H ' ' HE3' ' A' ' 84' ' ' LYS . 61.7 tp -63.08 -46.04 89.31 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' H ' ' HA ' ' A' ' 27' ' ' PRO . . . -60.01 -54.32 38.39 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.633 -0.794 . . . . 0.0 114.797 -177.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.7 tm-20 -73.2 -42.81 62.25 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 95.9 mt -67.6 -37.89 83.2 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 13.7 p -78.98 -32.48 45.27 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.883 -179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.31 -55.62 3.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.93 -44.58 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 80.9 mt -72.62 -19.27 61.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.249 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.2 t0 -60.49 -36.81 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.88 0.371 . . . . 0.0 110.829 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.1 m -86.01 5.14 34.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.108 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 52.0 t -65.33 141.94 58.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.291 0.567 . . . . 0.0 111.629 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -130.0 43.72 3.08 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.891 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.06 -12.5 69.07 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.402 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.3 97.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.037 0.418 . . . . 0.0 111.4 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.75 -23.38 10.65 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.649 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.41 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 78.41 109.9 0.19 Allowed Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.738 -178.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -52.73 -48.61 66.58 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 117.315 0.558 . . . . 0.0 110.674 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -83.74 1.28 43.49 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.576 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.67 -43.18 94.5 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.086 -178.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.2 mt -80.41 -41.58 24.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.029 0.415 . . . . 0.0 111.088 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.536 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -63.64 -41.68 98.21 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -60.18 -46.2 90.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.303 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -67.51 -39.19 85.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.943 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.72 HD22 HD21 ' A' ' 77' ' ' LEU . 4.0 tt -65.76 -43.52 88.65 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.853 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.0 t -153.96 142.56 20.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 0.0 111.2 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.0 m -121.09 137.54 54.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.329 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.9 t -156.52 154.34 30.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.049 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.0 m-90 -71.54 136.79 47.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.629 0.252 . . . . 0.0 110.657 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.2 mt 64.12 14.91 8.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.066 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -65.08 -39.63 93.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.221 0.534 . . . . 0.0 111.061 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.794 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.5 m -68.11 -17.51 22.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.493 -179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.04 -47.84 84.52 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-O 120.608 0.242 . . . . 0.0 110.879 -178.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.419 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 25.9 p80 -78.5 -20.08 51.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.446 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.794 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.6 mt -62.23 -42.22 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.461 0.648 . . . . 0.0 110.068 178.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.568 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.0 mm-40 -69.54 -33.4 72.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.756 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.3 mttt -62.86 -48.3 79.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.584 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 57.3 mm-40 -89.81 -4.33 57.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.668 -0.645 . . . . 0.0 112.739 -178.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.3 p -57.38 -33.3 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.161 0.437 . . . . 0.0 111.173 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.27 -4.63 58.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.939 0.4 . . . . 0.0 110.571 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -107.13 22.45 15.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.059 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.65 13.4 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.257 -0.973 . . . . 0.0 114.595 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 102.21 144.67 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.858 1.263 . . . . 0.0 111.916 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.9 t -130.7 -31.61 1.75 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.195 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.502 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.21 -63.35 5.25 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.841 -1.171 . . . . 0.0 111.546 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.449 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -89.08 -39.91 13.31 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 59.1 ttt85 -62.37 -48.7 78.59 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.1 tp10 -63.43 -39.71 95.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.72 HD21 HD22 ' A' ' 53' ' ' LEU . 64.5 tp -61.05 -45.98 92.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.28 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 83.9 mt -69.51 -39.32 77.64 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.945 0.402 . . . . 0.0 110.979 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -77.01 -5.78 50.06 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.8 m -58.53 -40.15 82.15 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -86.42 -89.66 0.11 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.735 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.7 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -114.37 -55.01 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.734 ' HD3' HD23 ' A' ' 29' ' ' LEU . 1.2 ttmp? -132.05 -44.66 0.95 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 175.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 46.03 36.88 3.3 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.918 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 161.91 36.1 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.0 p -115.33 155.2 27.77 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.509 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.4 mp -60.56 -38.52 78.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.12 -179.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.517 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.47 -39.83 97.84 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.581 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.32 -45.3 91.95 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.636 0.255 . . . . 0.0 111.644 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -72.51 -26.0 61.61 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.832 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.746 HD21 HG12 ' A' ' 107' ' ' ILE . 53.6 mt -59.54 -38.22 80.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -61.79 -42.17 98.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.037 0.446 . . . . 0.0 109.998 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 91.1 t -70.72 -41.22 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.352 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.5 mp -59.01 -38.7 79.84 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.612 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -62.51 -40.24 96.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.867 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.53 -41.99 92.47 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.4 tpt -70.99 -38.73 72.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.419 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.0 30.19 35.7 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.177 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -79.36 107.43 12.11 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.044 0.449 . . . . 0.0 110.649 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.95 -41.45 95.48 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -61.33 -40.52 94.53 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.234 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.435 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.99 -39.74 90.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.5 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.594 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -63.12 -43.89 99.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.014 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -64.48 -41.42 96.5 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.523 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -80.87 -22.04 40.18 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.348 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.746 HG12 HD21 ' A' ' 92' ' ' LEU . 1.8 tp -62.04 -20.36 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 70.3 p -72.07 -11.26 60.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.639 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -83.49 15.98 2.82 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.887 0.375 . . . . 0.0 111.471 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' TYR . . . . . 0.508 ' CD1' HD13 ' A' ' 88' ' ' ILE . 63.4 t80 -94.92 124.72 39.13 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 110.814 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -142.39 72.59 0.38 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.403 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -147.6 155.93 42.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.683 0.277 . . . . 0.0 110.98 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.6 p -135.68 145.12 31.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.455 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.6 mt 62.75 38.9 11.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.57 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 78.1 p -77.25 155.84 81.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.208 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.0 144.58 99.46 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.021 2.48 . . . . 0.0 112.814 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.9 m -119.6 149.62 41.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.54 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.8 pm0 -67.2 151.57 47.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.341 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -82.05 -11.97 58.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.395 -179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 51.0 m 57.48 41.18 26.44 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.585 0.553 . . . . 0.0 111.372 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -111.67 126.25 54.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.256 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 65.95 -99.75 0.06 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.631 0.582 . . . . 0.0 111.422 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -119.12 139.7 51.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 110.689 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.45 -179.923 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 C--O 1.22 -0.495 0 N-CA-C 111.228 0.084 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.491 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.3 m -75.02 113.5 12.42 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 20' ' ' THR . 20.5 mt -159.81 162.14 34.7 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.64 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.2 tp -63.87 -50.04 70.39 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -81.62 -35.77 29.69 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.291 0.567 . . . . 0.0 111.792 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -112.56 71.01 0.73 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.679 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -44.68 156.92 0.33 Allowed Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 124.009 0.818 . . . . 0.0 111.955 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -39.03 165.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 125.09 3.86 . . . . 0.0 114.849 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -50.06 -8.95 0.14 Allowed 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 124.061 3.174 . . . . 0.0 114.906 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.548 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.92 -36.04 67.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.68 0.218 . . . . 0.0 110.673 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.7 tp -107.82 -78.65 0.58 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.529 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -61.87 -49.1 77.61 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.27 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.59 -51.6 58.11 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 120.405 -0.902 . . . . 0.0 114.535 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.444 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.4 tm-20 -72.67 -43.77 62.68 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.35 -38.94 88.77 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.9 p -75.21 -31.95 61.05 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.032 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.27 -55.95 3.77 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.4 t -64.47 -45.21 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.03 -18.59 61.94 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.06 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 16.9 t70 -59.96 -38.07 81.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.987 0.422 . . . . 0.0 110.772 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -83.3 3.02 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.444 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 48.3 t -62.37 141.53 58.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.402 0.62 . . . . 0.0 112.186 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -133.33 46.37 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.642 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.56 -12.86 68.25 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.462 -0.79 . . . . 0.0 113.177 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.71 98.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.964 0.382 . . . . 0.0 111.549 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -115.29 -25.2 8.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.174 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 80.14 107.58 0.27 Allowed Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.002 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -53.32 -46.0 69.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 117.244 0.522 . . . . 0.0 111.078 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.4 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.5 ptt180 -82.97 1.69 38.54 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.872 178.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.32 -44.13 93.53 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.323 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -73.55 -43.77 59.1 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.182 0.491 . . . . 0.0 111.211 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.78 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.67 -39.51 93.81 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.62 -42.62 97.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.795 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.473 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 121.089 0.471 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.47 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -76.13 -21.54 56.49 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.507 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.52 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.4 mt -59.47 -42.22 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.093 0.473 . . . . 0.0 110.632 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.456 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -66.51 -35.17 79.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.97 0.414 . . . . 0.0 110.946 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.8 mttt -63.02 -49.57 74.12 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -177.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 7.5 mt-10 -89.74 -2.95 58.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.5 p -54.51 -32.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 118.423 0.556 . . . . 0.0 111.432 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.12 -4.73 58.21 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.793 0.33 . . . . 0.0 111.007 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.8 mm100 -106.48 22.47 15.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.105 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.629 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.92 19.22 12.15 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.101 -1.047 . . . . 0.0 114.131 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 96.5 142.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.337 1.055 . . . . 0.0 111.862 177.594 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.5 t -131.0 -26.42 2.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.388 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.58 -64.58 4.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.095 -1.05 . . . . 0.0 111.892 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.7 m -88.32 -38.48 15.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 111.694 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.3 ttt-85 -60.37 -47.75 84.71 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -177.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.563 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.5 tt0 -63.21 -40.35 97.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.758 0.313 . . . . 0.0 110.866 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.78 HD22 ' HA ' ' A' ' 50' ' ' ALA . 59.0 tp -61.1 -46.45 90.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.65 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.495 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.2 mt -70.5 -38.58 74.34 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -75.7 -6.73 51.94 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.685 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.8 m -58.65 -40.13 82.57 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -86.26 -89.57 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.788 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.59 -86.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -114.13 -54.83 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.9 ttpp -132.66 -44.2 0.9 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.437 175.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.7 t30 47.76 35.78 5.04 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.753 0.821 . . . . 0.0 111.815 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.25 171.08 14.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.921 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -121.21 157.96 29.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.73 -39.09 78.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.69 -39.72 98.28 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.774 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.35 -45.52 90.82 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.606 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.54 -23.98 45.91 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.393 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.6 tp -59.36 -40.64 87.1 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.673 0.273 . . . . 0.0 110.724 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -62.24 -41.53 98.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.299 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -69.56 -41.11 80.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.0 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.2 mp -59.84 -41.12 90.68 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.826 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.61 -40.51 97.09 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.073 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.78 -46.18 89.21 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.823 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.3 mmm -70.09 -37.34 75.38 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.775 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.48 38.51 5.28 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.383 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.476 ' NE2' ' HB3' ' A' ' 44' ' ' LEU . 39.4 m170 -79.98 91.71 5.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.928 0.394 . . . . 0.0 110.631 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -62.9 -42.08 99.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.9 tpt85 -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 110.647 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.24 -38.91 88.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.731 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 45.1 mm -62.78 -39.56 85.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.863 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -60.25 -48.0 83.61 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.222 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.444 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -80.71 -22.04 40.68 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -178.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 3.1 tp -60.66 -20.66 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 120.871 0.367 . . . . 0.0 111.424 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -71.94 -12.22 61.15 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.609 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.25 -27.18 65.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.189 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.8 t80 . . . . . 0 CA--C 1.532 0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.891 179.582 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 . . . . . 0 C--O 1.217 -0.615 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.6 m -71.24 116.07 11.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.654 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.41 162.44 17.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.312 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -64.84 -50.46 66.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.02 -35.81 23.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.412 0.625 . . . . 0.0 111.408 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -110.11 70.67 0.73 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.146 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.9 mt -46.35 156.18 0.51 Allowed Pre-proline 0 N--CA 1.467 0.405 0 O-C-N 124.067 0.854 . . . . 0.0 111.69 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -38.83 165.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 124.98 3.787 . . . . 0.0 114.698 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.91 -8.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.2 3.266 . . . . 0.0 115.204 -178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.593 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.3 -36.64 66.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.975 0.352 . . . . 0.0 110.39 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.909 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.5 tp -106.65 -78.33 0.58 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.41 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.5 OUTLIER -60.5 -51.7 68.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.57 -51.26 60.13 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.639 -0.791 . . . . 0.0 114.826 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.498 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.3 tm-20 -70.88 -43.62 68.0 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.444 HD13 HG21 ' A' ' 74' ' ' THR . 95.4 mt -67.08 -38.8 86.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.3 p -72.19 -31.07 65.57 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.62 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.62 -55.49 3.96 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.53 -45.69 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -73.11 -19.16 61.2 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.377 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.7 t70 -60.11 -39.16 85.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.012 0.434 . . . . 0.0 111.098 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.9 m -90.22 9.12 29.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.971 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 t -68.02 143.82 55.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.205 0.526 . . . . 0.0 111.695 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.32 49.51 2.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.217 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.69 -12.57 69.21 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.561 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.71 98.73 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.16 0.505 . . . . 0.0 111.136 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.4 mt -119.44 -26.63 5.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.722 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.92 113.51 0.32 Allowed Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.894 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 9.6 p90 -53.29 -47.44 69.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.009 0.404 . . . . 0.0 110.473 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.9 ptt180 -84.29 1.11 46.39 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.917 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.69 -46.7 91.9 Favored Glycine 0 CA--C 1.517 0.199 0 C-N-CA 120.159 -1.02 . . . . 0.0 113.334 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.18 -42.61 59.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.017 0.408 . . . . 0.0 110.911 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.6 -40.43 96.91 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.37 -45.81 92.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.237 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 . . . . . 0 N--CA 1.462 0.144 0 CA-C-O 120.842 0.353 . . . . 0.0 111.234 179.034 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.463 0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -74.69 -25.08 58.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.962 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.536 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.7 mt -59.88 -43.4 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 110.161 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.555 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -66.99 -36.01 81.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.69 -49.08 76.52 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -90.18 -3.78 57.66 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.6 p -56.05 -34.41 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.271 0.487 . . . . 0.0 111.321 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.2 -4.21 58.31 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 110.813 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -105.67 21.93 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.751 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.617 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.04 21.42 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.362 -0.923 . . . . 0.0 114.276 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 94.91 141.56 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.319 1.047 . . . . 0.0 112.159 177.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.536 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.8 t -131.56 -29.89 1.71 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.42 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -53.02 -66.98 2.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.356 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.444 HG21 HD13 ' A' ' 33' ' ' LEU . 24.9 m -87.38 -36.71 17.62 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 122.625 -0.338 . . . . 0.0 111.525 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -60.77 -47.16 87.58 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 81.7 tt0 -62.11 -42.4 99.19 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.17 -45.62 90.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.291 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.637 HD22 ' HG3' ' A' ' 84' ' ' LYS . 97.3 mt -67.6 -40.21 84.77 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.843 0.354 . . . . 0.0 111.285 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -81.5 -5.85 58.37 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.6 t -58.99 -41.35 87.44 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.9 m95 -85.4 -89.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.796 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.53 -87.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -114.47 -54.29 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.909 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.0 ttpp -132.3 -43.51 0.94 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.4 t30 48.25 34.19 4.31 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.791 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.479 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.51 170.83 15.2 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.789 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 63.2 p -126.45 159.13 34.21 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.375 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.568 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.7 mp -59.7 -40.03 81.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.407 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.425 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.0 -39.49 97.14 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.546 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -63.82 -44.23 93.85 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.665 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -73.85 -27.58 61.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.736 -179.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.6 mt -60.28 -32.83 71.56 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.542 0.21 . . . . 0.0 111.442 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -61.03 -42.52 98.63 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.479 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -86.3 -23.21 6.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.411 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.8 mp -61.9 -43.25 99.24 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.833 0.349 . . . . 0.0 110.255 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -65.72 -39.95 91.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.739 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -64.21 -43.84 93.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.03 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -71.75 -39.13 70.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.595 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.24 33.36 6.0 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.551 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -75.92 86.28 2.86 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.065 0.459 . . . . 0.0 111.35 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.84 -41.21 95.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.549 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.24 -39.86 94.82 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.487 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.549 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.71 -38.81 86.3 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.731 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.1 mt -61.47 -43.67 97.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.278 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -61.48 -47.66 84.67 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.245 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.498 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -77.88 -22.46 49.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -179.149 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.593 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.1 tp -63.32 -19.99 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.773 0.321 . . . . 0.0 111.478 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.2 p -67.84 -12.84 61.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.429 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -69.83 -27.45 64.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.52 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 . . . . . 0 C--O 1.233 0.193 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 179.316 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 . . . . . 0 C--O 1.222 -0.393 0 N-CA-C 111.776 0.288 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t -74.43 125.37 28.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -178.44 4.99 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.492 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.05 -58.23 3.26 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -73.92 -35.73 64.64 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.554 0.692 . . . . 0.0 110.513 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -109.91 70.28 0.72 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.732 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.611 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.6 mt -48.34 156.38 0.81 Allowed Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.987 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -34.93 163.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 125.086 3.857 . . . . 0.0 115.17 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.24 -8.72 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 124.277 3.318 . . . . 0.0 115.054 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.62 -35.56 63.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.605 0.184 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HB3' ' A' ' 91' ' ' LEU . 6.6 tp -108.64 -79.19 0.58 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.3 tp -62.01 -47.75 83.37 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.63 -51.3 59.56 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.651 -0.785 . . . . 0.0 114.632 -177.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -70.5 -43.52 69.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.71 -38.44 86.74 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.967 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.8 p -73.25 -31.82 64.34 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.797 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.34 -54.49 4.56 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -178.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 71.5 t -64.54 -43.99 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.8 mt -71.09 -18.25 62.55 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.419 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 5.7 t70 -59.58 -37.81 79.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 0.0 110.661 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.1 m -86.75 7.39 26.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.9 t -65.54 140.01 58.52 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.345 0.593 . . . . 0.0 111.746 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -131.42 44.06 2.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.454 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.59 -10.91 72.21 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.392 -0.822 . . . . 0.0 113.017 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.19 97.71 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.905 0.352 . . . . 0.0 111.562 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -116.24 -22.19 8.98 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.53 113.72 0.25 Allowed Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.764 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -52.37 -49.2 64.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.284 0.542 . . . . 0.0 109.925 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.455 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.6 ptt180 -83.93 1.38 43.73 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.562 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.62 92.33 Favored Glycine 0 CA--C 1.516 0.129 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.437 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.409 HD22 HD12 ' A' ' 95' ' ' LEU . 89.3 mt -73.7 -43.32 59.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 0.0 111.223 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.517 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.53 -39.9 94.63 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -59.69 -45.05 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.383 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 . . . . . 0 N--CA 1.463 0.223 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.745 179.445 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 N--CA 1.462 0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -68.84 -26.36 65.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.023 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.654 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.9 mt -59.67 -38.99 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.183 0.516 . . . . 0.0 110.455 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.491 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.4 mm-40 -79.66 -21.24 45.01 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.106 -0.371 . . . . 0.0 111.193 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.17 -45.41 60.53 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.621 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.3 mt-10 -87.97 -4.72 58.78 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.8 p -58.56 -28.55 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.236 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -74.73 -14.75 60.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -95.66 9.06 41.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.917 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 71' ' ' LYS . . . 104.22 -7.2 47.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 118.33 -1.261 . . . . 0.0 114.866 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 2.0 tppt? 158.58 139.1 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.263 1.032 . . . . 0.0 112.088 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.654 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.0 t -134.27 -24.17 1.64 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.46 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.23 -67.43 2.22 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.97 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.3 m -88.62 -35.12 17.03 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.569 -0.371 . . . . 0.0 111.482 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.551 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 74.0 ttt180 -60.75 -46.35 90.78 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.731 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 72' ' ' SER . 80.7 tt0 -60.54 -44.27 96.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 110.52 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.517 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -62.54 -47.82 82.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.253 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.906 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.3 mt -65.16 -39.81 93.45 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.53 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -81.0 -5.75 57.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.8 m -59.34 -39.84 84.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 65.8 m95 -86.27 -89.97 0.11 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.278 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.82 -87.07 0.49 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.134 0.492 . . . . 0.0 110.053 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -112.62 -56.75 2.37 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.906 ' HG3' HD22 ' A' ' 78' ' ' LEU . 13.6 ttpp -131.95 -43.57 0.98 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.564 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.6 t30 49.73 28.93 2.89 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.975 -1.012 . . . . 0.0 112.91 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.611 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 37.8 mttp -135.51 134.17 39.22 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 44.5 p -83.82 161.19 21.01 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.61 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.06 -40.33 82.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.143 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.36 -40.21 98.66 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.49 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -63.46 -48.59 77.08 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.921 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -75.98 -24.11 55.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.862 -179.625 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.722 HD13 HD13 ' A' ' 107' ' ' ILE . 62.4 tp -58.82 -39.38 81.01 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.425 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.88 -41.16 95.43 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.868 0.366 . . . . 0.0 110.452 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.7 -40.71 84.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 121.224 0.535 . . . . 0.0 109.729 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -60.31 -39.92 88.72 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.613 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.39 -40.02 96.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.812 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -63.94 -41.67 97.55 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.731 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.0 tpt -70.05 -38.84 75.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.086 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.29 29.77 11.92 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.721 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.22 99.47 4.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.924 0.392 . . . . 0.0 111.06 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.58 -41.83 96.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.669 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -62.31 -41.39 98.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.125 0.488 . . . . 0.0 110.805 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.89 -39.88 90.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.701 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.561 ' O ' HG22 ' A' ' 107' ' ' ILE . 42.0 mm -62.66 -45.21 99.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -66.51 -40.76 89.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 106' ' ' LEU . 1.3 tp -83.89 -21.79 31.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.722 HD13 HD13 ' A' ' 92' ' ' LEU . 10.2 tt -65.79 -20.22 26.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.927 0.394 . . . . 0.0 111.321 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.0 p -70.05 -9.93 57.0 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.814 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.41 -17.62 63.02 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.611 ' HE1' HD22 ' A' ' 25' ' ' LEU . 89.7 t80 . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 120.779 0.323 . . . . 0.0 110.352 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.5 m80 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.9 t -81.64 113.58 19.75 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.7 mt -153.36 167.09 30.57 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.836 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.13 -50.19 71.42 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -81.8 -35.58 29.36 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.493 0.663 . . . . 0.0 111.348 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.42 71.85 0.76 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.009 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -44.53 155.45 0.37 Allowed Pre-proline 0 CA--C 1.538 0.515 0 O-C-N 123.978 0.798 . . . . 0.0 111.22 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -38.69 165.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 124.846 3.697 . . . . 0.0 114.794 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -49.05 -8.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 124.01 3.14 . . . . 0.0 114.99 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.778 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.76 -35.79 64.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.741 0.246 . . . . 0.0 110.657 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.38 -78.64 0.59 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.4 tp -61.39 -48.65 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -51.1 60.73 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.595 -0.812 . . . . 0.0 114.494 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -70.79 -43.0 69.59 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.9 -38.68 86.73 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.842 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.661 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -73.25 -30.52 63.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.656 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.81 -55.45 3.96 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.72 -45.64 96.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.883 HD11 HD12 ' A' ' 49' ' ' LEU . 88.7 mt -71.62 -21.01 61.9 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.12 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.8 t0 -61.55 -38.65 88.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.039 0.447 . . . . 0.0 110.503 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.4 p -85.2 1.54 47.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.107 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.6 t -64.22 141.33 58.81 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.297 0.57 . . . . 0.0 111.663 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.91 39.04 3.85 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.926 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.18 -16.73 57.89 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.06 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.06 99.34 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.971 0.415 . . . . 0.0 111.816 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.89 -21.56 12.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.183 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.435 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.11 107.05 0.12 Allowed Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.563 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.2 p90 -52.88 -50.81 63.12 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 117.313 0.557 . . . . 0.0 110.349 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.542 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.77 -0.04 52.37 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.095 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.42 95.57 Favored Glycine 0 C--O 1.23 -0.115 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.023 -177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 37' ' ' LEU . 94.0 mt -81.79 -42.4 19.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.735 0.303 . . . . 0.0 111.215 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.45 -41.73 96.37 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -61.48 -41.26 96.98 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.115 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 120.76 0.314 . . . . 0.0 111.203 179.176 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 CA--C 1.529 0.163 0 CA-C-O 120.637 0.256 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -72.66 -29.5 63.49 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.216 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.562 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.7 mt -60.23 -43.11 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.537 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.1 mm-40 -67.64 -35.93 79.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.238 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.2 -48.61 79.24 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -89.95 -3.47 58.01 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -55.85 -34.04 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 118.202 0.455 . . . . 0.0 111.432 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.22 -4.77 58.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.935 0.397 . . . . 0.0 110.853 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.48 21.81 16.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.818 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.13 21.22 9.65 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.311 -0.947 . . . . 0.0 114.22 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 94.18 141.77 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.281 1.032 . . . . 0.0 112.248 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.565 ' H ' ' HD3' ' A' ' 71' ' ' LYS . 4.1 t -129.99 -30.38 2.01 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.998 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.35 -66.07 3.05 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.022 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.456 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.02 -35.6 18.69 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.494 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.7 ttt180 -62.69 -47.22 84.6 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.552 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -62.34 -41.33 98.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.615 0.245 . . . . 0.0 111.152 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.482 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.9 tp -61.07 -47.22 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.979 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.46 HD22 ' HG3' ' A' ' 84' ' ' LYS . 84.2 mt -71.46 -39.4 70.98 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.069 0.462 . . . . 0.0 111.673 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -76.62 -7.26 54.9 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -58.43 -38.59 77.75 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -87.58 -90.57 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.676 -0.409 . . . . 0.0 110.928 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.44 -86.81 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -110.96 -56.89 2.31 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.62 -43.49 0.91 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.419 176.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.4 36.21 6.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.718 0.807 . . . . 0.0 111.788 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.99 171.05 14.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.485 -179.264 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.8 p -121.21 157.4 30.34 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.324 179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.449 HG13 HD13 ' A' ' 29' ' ' LEU . 1.2 mp -60.5 -39.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.374 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.97 -39.45 98.08 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.862 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -63.23 -45.67 90.53 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.604 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.49 -24.6 50.1 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.658 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.509 HD13 HD13 ' A' ' 107' ' ' ILE . 61.8 tp -58.97 -41.74 88.24 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.176 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.94 -41.81 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.087 0.47 . . . . 0.0 110.471 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.0 t -68.3 -42.06 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.431 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.0 mp -60.28 -40.17 89.47 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.004 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.1 -39.21 93.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.495 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -62.61 -45.33 93.34 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.476 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 14.5 tpt -72.61 -39.41 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.257 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.37 39.55 3.44 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.472 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.407 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 13.3 t-160 -80.47 95.23 6.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.177 0.513 . . . . 0.0 110.546 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.89 -42.3 94.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -62.77 -39.38 94.0 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.855 0.36 . . . . 0.0 111.695 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.407 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -60.54 -38.7 85.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.279 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -60.93 -43.27 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.035 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -62.96 -42.08 99.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.03 -31.13 25.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.778 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.0 tt -62.3 -24.49 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.18 0.514 . . . . 0.0 110.47 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 85.1 m -64.88 -26.13 68.19 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.076 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -67.92 -20.44 65.09 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.574 ' HE1' HD22 ' A' ' 25' ' ' LEU . 81.0 t80 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.22 -0.452 0 N-CA-C 111.264 0.098 . . . . 0.0 111.264 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -72.61 115.08 11.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.794 0.33 . . . . 0.0 111.886 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 24' ' ' ASP . 23.8 tp -152.85 163.24 40.12 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.94 -47.63 85.54 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -90.87 -35.83 14.54 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.425 0.631 . . . . 0.0 110.555 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 83' ' ' GLN . 49.2 t0 -94.03 74.91 4.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.737 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.431 HD13 ' CE1' ' A' ' 110' ' ' TYR . 82.5 mt -47.37 154.21 0.86 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.357 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -38.61 166.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 124.82 3.68 . . . . 0.0 114.894 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.78 -9.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 124.312 3.341 . . . . 0.0 115.545 -178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.04 -34.82 63.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.087 0.403 . . . . 0.0 109.987 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.876 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.6 tp -107.79 -77.88 0.59 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -61.7 -52.03 65.95 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -178.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.44 -50.57 66.32 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.343 -0.932 . . . . 0.0 114.82 -177.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.84 -43.74 74.87 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 95' ' ' LEU . 97.1 mt -68.23 -39.19 82.4 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 120.69 -0.404 . . . . 0.0 112.054 -179.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.0 p -71.6 -27.99 63.5 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.357 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.72 -57.54 3.01 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.36 -45.26 96.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.63 HD11 HD12 ' A' ' 49' ' ' LEU . 97.6 mt -70.69 -22.49 62.46 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.68 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.6 t0 -61.11 -36.5 79.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.981 0.42 . . . . 0.0 110.872 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.3 m -88.06 11.45 16.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.119 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 46.2 t -62.16 143.24 57.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.564 0.697 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -131.9 36.97 3.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.393 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.64 -13.96 66.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.925 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.84 96.29 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.56 -25.5 9.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.11 0.481 . . . . 0.0 110.561 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.457 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 77.22 109.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.184 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.1 p90 -52.7 -49.85 64.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.377 0.588 . . . . 0.0 110.625 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.437 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.5 ptt180 -83.91 -0.38 51.15 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.485 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.43 -45.96 93.7 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.704 -177.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.63 HD12 HD11 ' A' ' 37' ' ' LEU . 90.6 mt -74.86 -44.14 50.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.213 0.53 . . . . 0.0 111.17 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -39.91 94.5 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.0 tp10 -59.23 -44.45 92.31 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.522 0.514 . . . . 0.0 111.371 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 mtt85 . . . . . 0 C--N 1.333 -0.136 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.708 179.247 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 . . . . . 0 N--CA 1.462 0.149 0 CA-C-O 120.922 0.391 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.452 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -77.17 -22.33 52.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.174 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.599 ' O ' HG13 ' A' ' 67' ' ' VAL . 78.9 mt -60.2 -42.62 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.9 0.381 . . . . 0.0 110.835 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 67' ' ' VAL . 80.3 mm-40 -71.48 -20.99 62.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.531 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -72.11 -46.66 55.8 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 67.3 mm-40 -89.78 -2.98 58.37 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -177.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 63' ' ' ILE . 16.2 m -55.43 -32.22 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.95 0.795 . . . . 0.0 111.942 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -88.44 -5.63 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.471 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -107.97 18.21 21.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.51 23.5 7.92 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.113 -1.042 . . . . 0.0 114.934 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 95.3 143.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.249 1.02 . . . . 0.0 112.559 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.612 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.1 t -132.64 -32.13 1.31 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.301 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.31 -67.39 1.99 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.697 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.2 m -86.89 -36.35 18.46 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.652 0.263 . . . . 0.0 111.283 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.98 -47.98 83.94 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.4 tt0 -61.42 -43.18 99.32 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.575 0.226 . . . . 0.0 111.26 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.1 tp -62.31 -45.46 93.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.115 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.527 HD22 ' HG3' ' A' ' 84' ' ' LYS . 94.5 mt -69.4 -38.72 78.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.853 0.359 . . . . 0.0 111.356 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 22.5 m95 -77.31 -5.87 51.12 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.7 m -59.1 -39.67 82.95 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -86.12 -89.95 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.987 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.39 -87.52 0.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.569 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 97.7 mm-40 -111.8 -53.95 2.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.876 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.5 ttpp -133.14 -43.88 0.86 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.938 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.8 t30 48.59 37.99 10.35 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.137 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 171.96 13.52 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.9 p -120.69 156.14 32.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.428 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -60.54 -38.62 78.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.106 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.58 -39.76 98.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.751 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.3 -45.73 90.03 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.623 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.18 -24.72 51.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.382 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.469 ' HA ' HD12 ' A' ' 95' ' ' LEU . 60.7 tp -59.83 -41.65 91.79 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.851 0.358 . . . . 0.0 110.85 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -62.55 -40.42 96.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.093 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.541 HG12 HD22 ' A' ' 49' ' ' LEU . 85.8 t -68.1 -40.07 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.11 178.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 33' ' ' LEU . 91.5 mt -61.09 -39.22 89.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.451 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -62.77 -39.33 93.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.568 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -62.37 -39.87 94.6 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.698 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -12.12 41.03 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.75 39.88 59.26 Favored Glycine 0 C--N 1.329 0.157 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.725 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -70.75 93.43 0.95 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.113 0.483 . . . . 0.0 110.608 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.64 ' O ' HG22 ' A' ' 104' ' ' ILE . 82.9 mtt85 -64.5 -42.25 95.94 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -66.59 -39.43 88.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.78 -39.07 87.49 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 101' ' ' ARG . 8.5 tp -62.83 -31.87 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.44 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -70.57 -41.2 72.72 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.71 0.29 . . . . 0.0 111.228 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.29 -22.19 30.79 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.558 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.8 tp -62.03 -20.49 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 120.93 0.395 . . . . 0.0 111.231 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.4 p -70.39 -12.54 61.65 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.663 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.87 -26.8 64.36 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.76 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.431 ' CE1' HD13 ' A' ' 25' ' ' LEU . 78.1 t80 . . . . . 0 CA--C 1.531 0.247 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.244 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 . . . . . 0 C--O 1.224 -0.237 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 t -78.77 130.87 36.23 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -176.84 2.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.012 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mp -79.88 -57.62 3.56 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -72.92 -35.35 67.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.584 0.707 . . . . 0.0 110.7 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.27 71.1 0.73 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.165 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.532 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.4 mt -49.34 157.1 0.94 Allowed Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.077 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -37.28 163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 124.478 3.452 . . . . 0.0 115.009 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -49.52 -9.09 0.12 Allowed 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 124.146 3.23 . . . . 0.0 114.95 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.682 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.19 -36.38 65.83 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 121.98 0.112 . . . . 0.0 110.995 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.934 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.02 -78.12 0.59 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.87 -47.6 84.25 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -52.92 49.39 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.333 -0.937 . . . . 0.0 114.73 -177.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.688 ' HB2' HD23 ' A' ' 106' ' ' LEU . 15.1 tm-20 -71.94 -43.88 64.5 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.89 -39.44 87.46 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.3 p -73.97 -30.83 62.71 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 120.121 -0.632 . . . . 0.0 111.838 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.4 -56.32 3.58 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.64 -45.22 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -177.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.428 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 83.9 mt -74.51 -17.34 60.77 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.165 -0.334 . . . . 0.0 111.42 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 7.3 t70 -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.028 0.442 . . . . 0.0 110.976 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 59.1 m -88.85 10.79 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.53 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.0 t -67.49 145.2 55.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.087 0.47 . . . . 0.0 111.199 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.95 50.75 2.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.72 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.96 -12.73 69.32 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.9 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.58 98.79 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 117.285 0.542 . . . . 0.0 110.992 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -120.52 -30.49 4.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.329 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.31 118.08 1.04 Allowed Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.544 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.404 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 6.4 p90 -56.0 -43.03 77.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.057 0.428 . . . . 0.0 110.348 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.0 ptt180 -83.66 0.44 46.93 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.419 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.3 -50.2 63.77 Favored Glycine 0 CA--C 1.516 0.148 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.914 -177.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -71.99 -42.0 66.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.288 0.544 . . . . 0.0 111.496 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.58 -42.71 91.45 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.33 -45.76 92.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.286 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH2' ' HG2' ' A' ' 97' ' ' GLU . 99.7 mtt180 . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.716 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.462 0.162 0 CA-C-O 120.762 0.315 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.46 -28.15 61.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.559 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.519 ' O ' ' HB3' ' A' ' 72' ' ' SER . 84.8 mt -60.1 -44.05 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.331 0.586 . . . . 0.0 110.03 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -66.78 -37.09 83.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.249 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.96 -46.71 86.44 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.0 mt-10 -89.78 -4.28 57.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.4 p -56.87 -33.31 41.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 118.361 0.528 . . . . 0.0 111.141 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.87 -4.36 58.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.931 0.396 . . . . 0.0 110.842 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -106.58 21.61 17.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.84 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.641 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.94 21.56 9.5 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.233 -0.984 . . . . 0.0 114.282 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.641 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.1 OUTLIER 95.24 147.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.602 1.161 . . . . 0.0 111.667 177.687 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.3 t -134.8 -36.57 0.84 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.401 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.22 -66.0 2.61 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.486 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 20.6 m -86.18 -37.51 18.63 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 122.352 -0.499 . . . . 0.0 111.273 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -60.95 -47.17 87.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.1 tt0 -62.32 -42.17 99.15 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.626 0.25 . . . . 0.0 110.817 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.479 HD22 ' HA ' ' A' ' 50' ' ' ALA . 63.2 tp -61.32 -46.24 91.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.578 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.5 mt -70.06 -39.13 75.86 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.432 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -79.57 -4.88 53.52 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.2 m -58.37 -39.77 80.47 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -86.37 -90.01 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.959 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.96 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.3 0.571 . . . . 0.0 109.724 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -111.88 -57.11 2.31 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.934 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.0 ttpp -132.24 -43.45 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.184 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.24 34.72 4.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.816 0.847 . . . . 0.0 111.647 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.36 170.89 15.11 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.6 p -122.57 158.72 29.29 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.336 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.647 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.39 -40.82 82.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.144 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.86 98.26 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.719 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.67 -45.86 88.19 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.558 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.78 -24.5 52.89 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.5 tp -60.03 -40.8 90.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.409 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.41 -43.21 99.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.937 0.399 . . . . 0.0 110.791 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 81.4 t -70.3 -40.05 77.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 121.618 0.723 . . . . 0.0 109.65 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 100' ' ' HIS . 50.1 tp -60.85 -40.47 93.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.26 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -61.66 -38.88 89.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.407 ' HG2' ' NH2' ' A' ' 52' ' ' ARG . 86.3 tt0 -62.66 -42.4 99.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 52.2 tpp -70.61 -40.0 73.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.379 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 81.75 40.09 11.2 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.578 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.662 ' HB3' HD11 ' A' ' 95' ' ' LEU . 20.7 t-160 -75.84 111.79 11.56 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.373 0.606 . . . . 0.0 110.73 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.32 -43.04 92.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.552 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.4 tpp180 -69.74 -38.72 76.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.11 -42.04 93.86 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.501 ' O ' HG22 ' A' ' 107' ' ' ILE . 46.8 pt -70.66 -27.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.868 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.82 -49.91 70.99 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.214 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' A' ' 32' ' ' GLU . 12.3 tp -83.92 -22.92 31.39 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.682 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.2 tt -61.84 -21.75 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.107 0.48 . . . . 0.0 111.148 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 54.3 m -62.17 -25.32 67.7 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.399 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -70.33 -14.15 62.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.532 ' HE1' HD22 ' A' ' 25' ' ' LEU . 72.0 t80 . . . . . 0 N--CA 1.463 0.206 0 CA-C-O 120.755 0.312 . . . . 0.0 110.587 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.3 m80 . . . . . 0 C--O 1.217 -0.64 0 N-CA-C 111.295 0.109 . . . . 0.0 111.295 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -70.67 119.72 15.24 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.36 161.67 12.1 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.071 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.03 -50.5 66.0 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -81.24 -35.65 30.95 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.43 0.633 . . . . 0.0 111.341 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.52 70.77 0.72 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.627 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.514 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.3 mt -46.11 156.28 0.48 Allowed Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 123.904 0.753 . . . . 0.0 111.372 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -38.43 165.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 124.91 3.74 . . . . 0.0 114.725 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -49.33 -9.35 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.041 3.16 . . . . 0.0 114.996 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.69 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.48 -35.9 63.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.374 0.13 . . . . 0.0 110.734 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.895 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.74 -78.8 0.59 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 61.6 tp -61.42 -48.02 83.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.76 -51.52 58.14 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.654 -0.784 . . . . 0.0 114.467 -177.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.634 ' HB2' HD22 ' A' ' 106' ' ' LEU . 37.4 tp10 -70.57 -43.39 69.56 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.63 -39.34 88.24 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -71.78 -30.34 65.45 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 120.55 -0.46 . . . . 0.0 111.712 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.23 -56.75 3.38 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.3 t -64.26 -44.51 97.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.07 -19.15 61.86 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.351 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.495 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.0 t70 -59.75 -38.91 83.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 110.747 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.9 m -88.71 6.3 39.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.989 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.0 t -65.69 141.48 58.35 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.256 0.55 . . . . 0.0 111.536 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -132.68 50.68 2.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.252 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.98 -11.64 71.65 Favored Glycine 0 CA--C 1.52 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 113.49 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.8 98.52 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 117.253 0.527 . . . . 0.0 111.066 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -119.94 -23.31 6.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.909 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.47 111.69 0.2 Allowed Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.285 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 21.3 p90 -54.08 -44.4 71.14 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.235 0.518 . . . . 0.0 110.88 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.704 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.71 -0.08 52.32 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.781 178.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.96 -45.38 95.23 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.446 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.484 HD22 HG12 ' A' ' 94' ' ' VAL . 87.0 mt -71.55 -42.92 67.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.847 0.323 . . . . 0.0 111.163 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.808 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.34 -43.26 91.48 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.41 -40.08 95.35 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.694 -178.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.781 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.982 0.42 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 12.7 t60 -73.89 -25.97 60.29 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.287 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.704 HD13 ' HB3' ' A' ' 47' ' ' ARG . 81.2 mt -59.4 -42.25 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.068 0.461 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.474 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -69.51 -27.44 65.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.029 179.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -70.26 -50.07 43.38 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.322 1.231 . . . . 0.0 114.322 -178.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.2 mt-10 -89.53 -3.56 58.28 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.7 p -55.54 -34.62 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 118.158 0.435 . . . . 0.0 111.308 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.17 -4.12 58.36 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.942 0.401 . . . . 0.0 110.76 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -105.68 21.88 16.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.796 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.612 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.14 22.26 8.88 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.266 -0.969 . . . . 0.0 114.363 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 94.18 140.16 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.251 1.02 . . . . 0.0 112.212 177.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.9 t -131.87 -25.82 2.03 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.483 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.584 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.01 -66.19 3.03 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.023 -1.084 . . . . 0.0 112.11 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.422 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 21.4 m -87.58 -36.63 17.43 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.428 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.3 ttt180 -60.37 -47.95 83.86 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.744 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.57 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.3 tt0 -63.04 -40.61 98.24 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.868 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.808 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.15 -46.16 91.68 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.3 mt -68.74 -39.37 80.36 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.241 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -78.07 -5.64 52.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.3 m -58.92 -39.74 82.46 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -85.99 -89.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.42 -86.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -114.68 -54.01 2.61 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.895 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.62 -44.9 0.89 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.8 t30 47.87 32.17 2.63 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.221 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.509 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.38 132.57 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -81.95 160.45 23.35 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.65 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.562 HG23 HD11 ' A' ' 107' ' ' ILE . 1.2 mp -60.31 -38.94 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.122 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.99 -39.04 97.59 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.726 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.32 -46.26 89.52 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.59 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.55 -24.38 45.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 -179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 107' ' ' ILE . 61.4 tp -59.45 -40.53 87.16 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.627 0.251 . . . . 0.0 111.077 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -62.29 -41.3 98.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.559 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.484 HG12 HD22 ' A' ' 49' ' ' LEU . 87.5 t -69.63 -40.19 79.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.032 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 91' ' ' LEU . 3.7 mp -59.31 -36.95 76.55 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.241 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 92' ' ' LEU . 99.0 mm-40 -62.97 -39.9 96.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.287 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -62.57 -46.08 89.98 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.789 0.328 . . . . 0.0 110.718 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.1 mmt -70.36 -36.59 74.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.15 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 101' ' ' ARG . . . 93.53 40.61 4.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.245 -0.979 . . . . 0.0 111.983 -179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -76.89 86.95 3.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.317 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 99' ' ' GLY . 1.4 mpp_? -63.18 -43.35 98.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.529 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -63.32 -39.9 95.85 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.688 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.472 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.87 -37.79 83.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.569 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.3 mt -60.21 -43.18 92.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.615 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -63.93 -43.21 96.59 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.634 HD22 ' HB2' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -84.44 -23.05 30.13 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.106 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.69 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.7 tt -64.74 -20.96 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.845 0.355 . . . . 0.0 111.632 -179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 79.7 p -69.08 -16.7 63.74 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.448 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -71.73 -14.65 62.08 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.576 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.514 ' HE1' HD22 ' A' ' 25' ' ' LEU . 63.8 t80 . . . . . 0 CA--C 1.531 0.212 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.287 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.218 -0.565 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.8 m -75.61 117.44 17.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.652 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.9 169.21 21.63 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.735 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -64.18 -50.52 67.79 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.418 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . 99.7 m-85 -91.92 -35.68 13.88 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.277 0.56 . . . . 0.0 111.133 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.9 70.76 1.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.307 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.542 HD22 ' HE2' ' A' ' 110' ' ' TYR . 94.0 mt -47.43 156.32 0.64 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.642 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.55 166.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.257 3.972 . . . . 0.0 114.977 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.89 -8.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.232 0 C-N-CA 124.112 3.208 . . . . 0.0 115.312 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.7 -36.55 67.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 118.025 0.375 . . . . 0.0 110.219 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.97 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.66 -78.37 0.59 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.9 tp -61.11 -48.72 80.35 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.07 -51.26 59.54 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 120.473 -0.87 . . . . 0.0 114.343 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.467 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.39 -43.28 70.37 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.22 -37.89 84.35 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.61 -0.436 . . . . 0.0 112.085 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.7 p -75.28 -31.7 60.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.774 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.97 -56.89 3.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.439 HG11 ' HG2' ' A' ' 102' ' ' ARG . 61.4 t -63.49 -44.77 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 100' ' ' HIS . 70.5 mt -72.84 -19.42 61.31 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.187 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.621 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 39.6 t0 -62.02 -36.19 80.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.168 0.508 . . . . 0.0 110.158 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.8 m -88.1 7.41 31.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.996 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.7 t -62.76 142.77 58.02 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.411 0.624 . . . . 0.0 111.717 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -130.35 40.0 3.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.849 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.15 -11.96 69.81 Favored Glycine 0 CA--C 1.519 0.3 0 CA-C-N 115.456 -0.793 . . . . 0.0 113.094 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.77 -42.88 97.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.967 0.383 . . . . 0.0 111.654 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 92.0 mt -113.8 -22.06 10.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.078 0.466 . . . . 0.0 110.5 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.705 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.4 p90 -52.12 -52.38 51.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 117.107 0.454 . . . . 0.0 110.641 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.55 0.64 45.7 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.752 178.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.74 -47.08 91.03 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.158 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 HG12 ' A' ' 94' ' ' VAL . 94.7 mt -73.38 -43.19 61.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.96 0.38 . . . . 0.0 111.376 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.709 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.72 -40.73 95.82 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -60.68 -43.74 97.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.243 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 . . . . . 0 C--O 1.232 0.145 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.881 179.683 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.837 0.351 . . . . 0.0 110.411 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -68.17 -29.27 68.1 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.397 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.577 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.9 mt -60.01 -42.8 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.433 0.635 . . . . 0.0 109.63 178.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.19 -35.93 76.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.172 178.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -62.78 -47.59 82.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.528 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.1 mt-10 -89.56 -3.62 58.23 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.1 p -57.13 -32.48 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 118.18 0.445 . . . . 0.0 111.146 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.83 -4.67 58.43 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.922 0.391 . . . . 0.0 110.693 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -106.38 21.56 17.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.728 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.606 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 22.3 8.9 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.391 -0.909 . . . . 0.0 114.254 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 93.75 142.65 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.279 1.032 . . . . 0.0 112.129 177.512 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.6 t -130.74 -31.74 1.73 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.964 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.447 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.44 -62.99 5.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.299 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.515 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.14 -37.3 16.29 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.384 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.8 ttt180 -62.3 -47.41 84.41 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.56 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.7 tt0 -63.25 -40.02 96.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.734 0.302 . . . . 0.0 110.632 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.709 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.3 tp -61.16 -46.38 90.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.171 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.479 HD22 ' HG3' ' A' ' 84' ' ' LYS . 86.1 mt -71.17 -40.21 71.42 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.998 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -82.52 -5.94 59.03 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -59.13 -41.94 89.45 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -85.8 -89.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.48 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.19 -86.91 0.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.293 0.568 . . . . 0.0 110.596 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.418 ' OE1' ' HB2' ' A' ' 23' ' ' PHE . 91.8 mt-30 -112.46 -57.23 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.97 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.8 ttpp -131.73 -42.45 1.02 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.2 t30 49.28 30.44 3.16 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.135 0.974 . . . . 0.0 111.857 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 9.6 mptt -139.57 164.24 30.42 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.0 p -124.95 160.16 29.55 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.539 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.8 mp -59.45 -41.85 85.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.971 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.81 99.4 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.914 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.74 -40.28 95.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.629 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -74.87 -29.42 61.01 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.7 -179.58 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.566 HD21 HG12 ' A' ' 107' ' ' ILE . 74.4 mt -59.6 -37.51 78.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -58.97 -46.49 87.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.286 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.472 HG12 HD22 ' A' ' 49' ' ' LEU . 92.6 t -70.51 -39.57 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.727 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.0 mp -57.78 -39.47 77.55 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.35 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -63.8 -38.85 92.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.142 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -63.17 -40.6 98.0 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.913 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 95.7 mmm -90.4 -10.75 42.73 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.9 39.73 46.02 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.853 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.405 ' CD2' HD21 ' A' ' 37' ' ' LEU . 16.1 m80 -74.28 81.39 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.085 0.469 . . . . 0.0 111.579 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -63.21 -42.2 99.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.57 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.439 ' HG2' HG11 ' A' ' 36' ' ' VAL . 22.2 tpp85 -62.21 -41.55 98.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.025 0.44 . . . . 0.0 110.761 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.47 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.27 -39.17 89.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.305 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.5 mt -62.66 -42.89 97.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.631 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.16 -41.45 99.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.706 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.467 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.36 -23.51 37.67 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.599 HG22 ' O ' ' A' ' 104' ' ' ILE . 0.9 OUTLIER -64.82 -20.3 27.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.859 0.362 . . . . 0.0 111.251 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.0 p -71.03 -7.25 45.06 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.604 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -68.62 -27.1 65.73 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.758 0.313 . . . . 0.0 110.978 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.542 ' HE2' HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.223 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.223 -0.335 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.7 t -72.43 125.46 27.44 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.229 0.538 . . . . 0.0 112.422 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -167.56 -178.21 3.85 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.586 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -80.38 -58.98 2.88 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -72.9 -35.4 67.09 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.608 0.718 . . . . 0.0 110.691 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -110.56 71.33 0.75 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.092 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.604 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.3 mt -48.24 156.54 0.77 Allowed Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -36.12 163.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.632 3.555 . . . . 0.0 115.176 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -50.52 -8.9 0.16 Allowed 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 123.978 3.119 . . . . 0.0 114.634 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.688 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.17 -35.59 64.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.3 -79.5 0.58 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 62.4 tp -62.3 -47.68 83.21 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.45 -52.26 53.71 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.593 -0.813 . . . . 0.0 114.645 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -71.12 -43.23 68.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.35 -39.73 89.37 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.0 p -73.13 -30.14 63.4 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.847 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -55.82 3.81 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.63 -45.25 95.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.678 ' HB2' ' HZ1' ' A' ' 71' ' ' LYS . 82.6 mt -74.39 -17.82 60.75 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.713 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 19.3 t70 -59.56 -38.74 81.9 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.104 0.478 . . . . 0.0 110.541 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.6 p -90.29 10.04 26.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.354 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -66.5 147.24 53.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.18 0.514 . . . . 0.0 111.237 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -136.53 49.54 2.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.242 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.94 -10.3 74.77 Favored Glycine 0 CA--C 1.519 0.34 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.422 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.64 99.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 111.154 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -122.38 -32.39 3.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.17 114.92 1.4 Allowed Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.583 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.47 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 9.0 p90 -55.15 -44.17 74.86 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.036 0.418 . . . . 0.0 110.572 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.738 ' HB3' HD13 ' A' ' 63' ' ' ILE . 1.5 ppt_? -84.83 -0.5 54.14 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.728 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -48.69 83.41 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.299 -177.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 95' ' ' LEU . 95.0 mt -73.28 -41.82 63.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.9 0.381 . . . . 0.0 111.214 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.74 -43.1 97.47 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -60.73 -44.38 96.72 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.368 0.417 . . . . 0.0 111.636 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 . . . . . 0 C--N 1.332 -0.186 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 179.366 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.4 t70 . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.462 0.172 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.524 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 11.3 p-80 -78.69 -19.11 53.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.823 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.738 HD13 ' HB3' ' A' ' 47' ' ' ARG . 77.8 mt -61.96 -41.18 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 121.303 0.573 . . . . 0.0 110.457 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 67' ' ' VAL . 96.3 mt-10 -69.55 -34.0 73.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.995 178.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.2 mttt -62.4 -47.98 81.74 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.4 mm-40 -89.5 -4.31 57.98 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.7 p -57.11 -30.82 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 118.233 0.47 . . . . 0.0 110.894 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -88.33 -5.22 58.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.12 0.486 . . . . 0.0 110.596 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -109.36 22.91 15.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.766 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.682 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.61 11.55 30.59 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-O 118.858 -0.968 . . . . 0.0 114.633 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.682 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 105.73 147.76 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.112 1.365 . . . . 0.0 111.744 177.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.614 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.6 t -132.34 -26.06 1.9 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.762 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.92 -66.56 2.71 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 119.036 -1.554 . . . . 0.0 111.007 178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -87.03 -40.02 15.1 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 71' ' ' LYS . 76.0 ttt-85 -61.55 -47.91 83.41 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.9 tp10 -61.75 -43.05 99.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.515 0.198 . . . . 0.0 110.859 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.1 tp -63.59 -45.74 89.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.588 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.594 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.1 mt -67.16 -39.11 86.45 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.888 0.375 . . . . 0.0 111.178 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -78.2 -6.27 54.34 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.2 m -59.18 -39.74 83.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -85.9 -90.14 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.198 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.98 -86.49 0.5 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.168 0.509 . . . . 0.0 109.679 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -111.16 -57.61 2.22 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.2 ttpp -133.13 -42.76 0.88 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.71 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.0 t30 49.4 32.84 4.89 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.153 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.59 130.4 26.07 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.72 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 51.5 p -81.55 160.2 23.94 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.991 -0.683 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.5 -38.4 77.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.041 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.4 -39.32 97.62 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.915 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.98 -45.19 93.58 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.655 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -78.01 -23.94 48.1 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.397 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 107' ' ' ILE . 62.2 tp -58.98 -40.92 86.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.087 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -61.92 -41.48 97.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 110.265 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 76.5 t -67.98 -41.55 84.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.154 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.5 mp -60.15 -39.21 85.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.119 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -62.94 -40.63 98.23 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -65.19 -42.89 93.17 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.566 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.43 -38.56 81.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.196 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.69 26.15 39.51 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.612 -0.804 . . . . 0.0 113.464 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.413 ' NE2' ' HB3' ' A' ' 102' ' ' ARG . 20.7 t-160 -77.48 106.16 9.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.098 0.449 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.96 -42.23 97.33 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.413 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.2 tpp180 -62.57 -42.25 99.43 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.865 0.364 . . . . 0.0 110.96 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.63 -42.04 98.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.497 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.653 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.2 mt -64.24 -43.28 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.38 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -61.0 -47.96 84.03 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.443 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -76.99 -24.94 52.22 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.688 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.9 tt -64.7 -20.68 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 120.816 0.341 . . . . 0.0 111.723 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 72.2 p -75.62 -8.09 55.92 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.595 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -87.49 16.09 5.88 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.029 0.442 . . . . 0.0 111.238 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.604 ' HE1' HD22 ' A' ' 25' ' ' LEU . 58.9 t80 . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.672 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.219 -0.534 0 CA-C-O 120.457 0.17 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -70.79 120.03 15.8 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.12 164.45 20.29 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.484 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.43 -50.37 70.03 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.62 -35.36 14.27 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.143 0.496 . . . . 0.0 111.589 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -103.61 70.8 1.04 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.46 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.0 mt -43.51 157.51 0.26 Allowed Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 124.283 0.989 . . . . 0.0 112.454 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -42.32 167.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 124.621 3.547 . . . . 0.0 113.845 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.73 -9.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.821 3.014 . . . . 0.0 115.083 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.5 -35.36 67.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.868 0.303 . . . . 0.0 110.937 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.834 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.0 tp -107.24 -77.55 0.6 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -49.75 71.11 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.34 -52.29 54.08 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.559 -0.829 . . . . 0.0 115.049 -177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.8 tm-20 -71.28 -43.82 66.42 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.68 -39.58 88.2 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 19.2 p -74.32 -32.97 63.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.191 -0.604 . . . . 0.0 112.17 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.7 -54.52 4.48 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.458 HG11 ' HG2' ' A' ' 102' ' ' ARG . 56.9 t -64.19 -44.83 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.512 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 mt -75.64 -17.23 60.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.37 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.634 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 36.5 t0 -60.66 -37.13 80.56 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.054 0.454 . . . . 0.0 110.967 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.9 m -85.72 9.6 15.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.128 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.426 ' SG ' HD12 ' A' ' 44' ' ' LEU . 48.3 t -66.18 144.66 56.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.254 0.549 . . . . 0.0 111.883 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -133.63 46.26 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.87 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.4 -11.99 70.51 Favored Glycine 0 CA--C 1.519 0.33 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.391 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.82 -42.46 97.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.956 0.407 . . . . 0.0 111.551 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.426 HD12 ' SG ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -117.05 -26.15 6.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.308 179.095 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.403 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.63 108.07 0.25 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.165 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 16.0 p90 -54.89 -40.3 69.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 117.211 0.505 . . . . 0.0 111.125 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.607 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -83.04 1.06 41.99 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.996 178.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.71 -43.52 96.31 Favored Glycine 0 C--N 1.329 0.177 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.713 -178.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.561 HD12 ' HB ' ' A' ' 74' ' ' THR . 94.2 mt -71.41 -42.4 68.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.768 0.318 . . . . 0.0 111.003 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.54 -40.59 93.06 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.03 -41.11 97.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.996 -178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.854 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 N--CA 1.464 0.268 0 CA-C-O 120.992 0.425 . . . . 0.0 110.672 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -74.38 -22.43 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.419 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.607 HD13 ' HB3' ' A' ' 47' ' ' ARG . 80.6 mt -59.86 -43.73 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.11 0.481 . . . . 0.0 110.5 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.517 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.9 mt-10 -66.94 -36.58 82.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.957 0.408 . . . . 0.0 110.935 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.34 -47.2 83.15 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -177.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 6.1 mt-10 -90.05 -4.08 57.59 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.1 p -56.54 -32.62 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.209 0.459 . . . . 0.0 111.235 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.82 -4.73 58.41 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.853 178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -106.08 21.31 17.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.907 -178.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.64 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.62 21.15 10.01 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.259 -0.972 . . . . 0.0 114.233 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.64 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 98.9 148.01 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.568 1.147 . . . . 0.0 112.04 177.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.1 t -137.13 -37.26 0.65 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.659 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.649 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.68 -62.8 4.94 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.931 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.561 ' HB ' HD12 ' A' ' 49' ' ' LEU . 9.2 t -88.21 -36.06 16.99 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.266 0.533 . . . . 0.0 111.712 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.18 -47.27 85.24 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.2 tt0 -62.58 -40.14 95.93 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.645 0.26 . . . . 0.0 110.641 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.7 tp -61.51 -46.96 87.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.531 HD22 ' HG3' ' A' ' 84' ' ' LYS . 91.1 mt -72.26 -39.88 68.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.566 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -78.09 -6.77 55.71 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.9 p -57.86 -38.63 76.05 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -87.38 -91.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.016 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.94 -86.8 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -108.7 -57.87 2.08 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.834 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.2 ttpp -133.07 -43.84 0.87 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.94 176.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.2 t30 47.97 34.7 4.3 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.556 0.742 . . . . 0.0 111.911 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -139.45 168.14 20.49 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 64.8 p -124.84 158.59 33.07 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.528 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 29' ' ' LEU . 1.2 mm -60.56 -37.66 75.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.924 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.91 -41.35 99.27 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.716 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.47 -42.34 83.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.057 0.456 . . . . 0.0 111.036 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -75.59 -24.14 56.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.802 -179.476 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.52 -42.14 91.57 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.945 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -62.09 -41.59 98.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.433 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -69.09 -41.24 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.062 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.706 HD13 HD12 ' A' ' 91' ' ' LEU . 2.0 mp -59.91 -42.96 95.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.253 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -63.9 -40.8 97.33 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.204 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -63.95 -46.71 83.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.4 mmm -70.29 -38.57 75.04 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.73 40.0 5.41 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.446 -0.883 . . . . 0.0 113.266 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.416 ' CE1' ' HB3' ' A' ' 44' ' ' LEU . 99.0 m-70 -78.44 97.18 5.58 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.994 0.397 . . . . 0.0 110.588 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.526 ' O ' HG12 ' A' ' 104' ' ' ILE . 83.6 mtp180 -63.67 -41.83 98.13 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.691 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.458 ' HG2' HG11 ' A' ' 36' ' ' VAL . 6.5 tpm_? -65.41 -37.56 87.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.044 0.449 . . . . 0.0 111.666 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.31 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.681 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.619 ' O ' HG22 ' A' ' 107' ' ' ILE . 36.9 pt -69.03 -25.76 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.429 -179.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -70.56 -39.97 73.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.863 0.364 . . . . 0.0 110.717 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.427 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -84.93 -22.8 29.11 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.737 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -61.97 -21.18 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.642 0.258 . . . . 0.0 111.328 -179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.4 t -65.77 -16.71 64.04 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.598 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -78.1 -10.44 59.62 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 0.0 111.421 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.528 179.026 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 . . . . . 0 C--O 1.219 -0.535 0 N-CA-C 111.442 0.164 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.418 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.4 m -78.64 113.91 17.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.504 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 20.6 mt -155.96 165.58 36.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.005 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.6 tp -62.77 -49.46 74.91 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -83.27 -35.39 25.35 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.156 0.503 . . . . 0.0 112.007 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -113.09 71.23 0.74 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.703 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.44 HD13 ' CE1' ' A' ' 110' ' ' TYR . 86.1 mt -41.0 155.4 0.21 Allowed Pre-proline 0 CA--C 1.54 0.577 0 O-C-N 123.926 0.766 . . . . 0.0 112.008 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.2 Cg_exo -38.01 164.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 125.041 3.827 . . . . 0.0 114.848 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.21 -9.17 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 124.131 3.221 . . . . 0.0 115.18 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.607 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.94 -35.55 64.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 117.634 0.197 . . . . 0.0 110.521 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.91 -79.12 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.21 -47.44 84.42 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.51 -51.12 60.69 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.523 -0.846 . . . . 0.0 114.14 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.96 -43.26 68.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.59 -38.68 84.38 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -73.97 -30.85 62.72 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.644 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.5 -57.35 3.1 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.66 -45.58 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 HD12 ' A' ' 49' ' ' LEU . 84.0 mt -72.61 -19.51 61.45 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.485 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 37.0 t0 -61.29 -37.29 82.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 110.28 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -85.69 1.65 48.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.014 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -63.45 139.34 58.76 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.224 0.535 . . . . 0.0 111.553 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.52 45.78 2.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.938 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.04 -10.96 73.01 Favored Glycine 0 CA--C 1.52 0.35 0 CA-C-N 115.535 -0.757 . . . . 0.0 113.127 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.11 98.76 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.994 0.397 . . . . 0.0 111.347 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.68 -23.6 9.15 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.78 110.37 0.3 Allowed Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.393 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.9 p90 -50.95 -50.35 58.11 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 117.293 0.546 . . . . 0.0 110.627 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.656 ' HB3' HG21 ' A' ' 63' ' ' ILE . 47.0 ptt85 -84.04 1.33 44.41 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.694 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.91 -49.11 73.56 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.3 -177.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.511 HD12 HD11 ' A' ' 37' ' ' LEU . 95.9 mt -71.25 -41.63 69.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.073 0.437 . . . . 0.0 111.372 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.68 -41.4 96.08 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -60.55 -42.63 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.934 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.106 179.93 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 . . . . . 0 C--O 1.23 0.068 0 CA-C-O 121.174 0.511 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -70.74 -27.72 64.16 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.842 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.656 HG21 ' HB3' ' A' ' 47' ' ' ARG . 79.1 mt -59.97 -42.71 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.129 0.49 . . . . 0.0 110.572 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.4 mt-10 -65.92 -36.53 83.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.458 . . . . 0.0 110.847 178.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.53 -49.14 74.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.551 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 1.4 mm-40 -89.95 -3.45 58.03 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 6.2 p -56.18 -33.42 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 118.177 0.444 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.05 -4.34 58.4 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.808 0.337 . . . . 0.0 110.762 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.97 21.57 17.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.883 -178.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.86 20.79 10.24 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.282 -0.961 . . . . 0.0 114.269 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.0 OUTLIER 95.82 141.52 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.388 1.075 . . . . 0.0 112.161 177.493 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.7 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.4 t -131.12 -28.8 1.9 Allowed 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.331 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.486 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.23 -63.14 5.58 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.745 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.505 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.84 -40.12 13.36 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 179.224 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.55 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 76.9 ttt180 -62.31 -49.89 73.83 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -177.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.7 ' HB3' ' O ' ' A' ' 72' ' ' SER . 52.4 tp10 -64.51 -39.19 93.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.295 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.578 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.0 tp -60.51 -46.52 89.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.937 0.399 . . . . 0.0 110.338 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.487 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.7 mt -71.5 -39.59 70.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.195 0.522 . . . . 0.0 111.197 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -74.55 -6.47 48.65 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.616 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 t -58.03 -42.1 84.63 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 61.5 m95 -85.73 -90.05 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.988 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.71 -86.26 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.216 0.532 . . . . 0.0 109.575 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.48 -56.95 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.921 ' HD2' HD23 ' A' ' 29' ' ' LEU . 21.5 ttpp -132.02 -42.68 0.99 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.482 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 45.63 34.01 1.6 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.669 0.788 . . . . 0.0 112.563 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.5 169.01 18.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.3 p -119.38 158.32 26.41 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.469 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.23 -38.26 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.057 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.31 -39.6 97.95 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.824 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.83 -46.53 87.5 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.752 0.279 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.681 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.2 mm? -76.32 -24.49 54.31 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.286 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.07 -38.1 78.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -60.93 -41.83 96.98 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.839 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.09 -23.95 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.121 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.8 mp -62.78 -46.61 87.21 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 110.334 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.69 -39.44 91.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.626 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -63.29 -43.5 97.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.652 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -68.69 -38.75 80.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.88 22.86 19.51 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.095 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -78.08 99.02 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.087 0.47 . . . . 0.0 110.996 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.69 -40.8 96.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.809 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.19 -41.4 96.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.856 0.36 . . . . 0.0 110.739 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -39.49 90.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.304 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.627 ' O ' HG22 ' A' ' 107' ' ' ILE . 44.2 mm -63.97 -43.66 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.749 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -64.64 -40.78 96.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.648 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -79.79 -22.78 42.72 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.627 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.5 tp -64.55 -20.84 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.511 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.1 p -74.09 -10.18 59.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -89.03 16.28 7.32 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.195 0.522 . . . . 0.0 111.187 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.44 ' CE1' HD13 ' A' ' 25' ' ' LEU . 38.7 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.307 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 C--O 1.221 -0.398 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.2 m -67.64 119.66 12.76 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.74 0.305 . . . . 0.0 111.72 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.17 163.3 22.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.428 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.0 tp -64.38 -50.58 67.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -85.25 -35.38 21.6 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.565 0.697 . . . . 0.0 111.325 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.5 70.44 0.73 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.348 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.7 mt -45.84 155.52 0.49 Allowed Pre-proline 0 N--CA 1.466 0.356 0 O-C-N 124.161 0.913 . . . . 0.0 111.387 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -35.4 160.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 124.683 3.589 . . . . 0.0 114.888 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo -49.39 -9.17 0.11 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.338 3.359 . . . . 0.0 114.889 -178.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.32 -35.05 62.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.71 0.232 . . . . 0.0 110.676 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.928 HD23 ' HD2' ' A' ' 84' ' ' LYS . 7.5 tp -107.85 -78.28 0.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -61.32 -48.73 80.01 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.64 -52.73 48.93 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.676 -0.773 . . . . 0.0 114.817 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -72.2 -42.01 66.27 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 95' ' ' LEU . 92.6 mt -65.4 -38.76 90.93 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.675 -179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.6 p -72.15 -29.46 64.06 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.357 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 38' ' ' ASP . . . -85.53 -59.42 2.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.03 -44.44 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 33' ' ' LEU . 89.6 mt -70.81 -19.17 62.7 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.649 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 13.6 t70 -60.99 -37.15 81.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.982 0.42 . . . . 0.0 110.625 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 m -81.22 1.56 31.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 50.3 t -64.16 139.01 58.72 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.316 0.579 . . . . 0.0 111.916 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -129.4 43.67 3.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.358 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 95.26 -13.84 66.16 Favored Glycine 0 CA--C 1.521 0.424 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.791 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.88 97.12 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.762 0.315 . . . . 0.0 111.704 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.61 -17.34 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.113 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 72.49 105.54 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.549 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.476 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 7.8 p90 -51.63 -52.51 47.19 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.361 0.581 . . . . 0.0 110.338 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HB3' HG21 ' A' ' 63' ' ' ILE . 49.1 ptt85 -84.7 -0.32 53.14 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.651 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.41 -39.05 92.34 Favored Glycine 0 N--CA 1.46 0.276 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.87 -178.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.455 HD11 HD13 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -85.15 -45.41 12.08 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.787 0.327 . . . . 0.0 110.713 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.58 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -62.78 -40.49 97.48 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -61.41 -41.16 96.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.011 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 . . . . . 0 C--O 1.232 0.175 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.368 179.716 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.695 0.283 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.7 p-80 -85.68 -14.71 44.64 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.575 ' O ' ' HB3' ' A' ' 72' ' ' SER . 76.4 mt -59.8 -40.43 82.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 121.406 0.622 . . . . 0.0 109.518 178.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.455 ' O ' HG12 ' A' ' 67' ' ' VAL . 97.6 mt-10 -72.13 -21.33 61.48 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.601 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -73.85 -52.7 12.18 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 18.1 mt-10 -86.85 -3.51 59.08 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.2 p -57.36 -34.31 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.914 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -89.58 -4.52 57.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.07 0.462 . . . . 0.0 110.571 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -107.12 22.75 15.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.717 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 105.11 20.4 9.8 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.302 -0.951 . . . . 0.0 114.037 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 92.79 141.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.364 1.065 . . . . 0.0 112.155 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.575 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.2 t -130.18 -28.64 2.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.037 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.28 -64.49 4.34 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.072 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.453 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -87.68 -36.33 17.48 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.8 ttt180 -61.66 -47.98 82.89 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.622 -178.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 13.3 tm-20 -62.55 -40.71 97.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.62 0.248 . . . . 0.0 110.647 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.58 HD22 ' HA ' ' A' ' 50' ' ' ALA . 63.4 tp -60.55 -46.65 89.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.524 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.4 mt -70.37 -39.11 74.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.89 0.376 . . . . 0.0 111.721 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -78.35 -4.93 50.55 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.9 m -58.12 -40.16 80.54 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -86.54 -90.39 0.11 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.983 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.3 -86.92 0.5 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.6 -56.97 2.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.928 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.54 -43.7 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.2 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 t30 48.03 35.74 5.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.702 0.801 . . . . 0.0 111.605 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.43 171.24 14.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.713 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.3 p -123.78 158.42 31.79 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.221 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.63 -41.28 84.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.268 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -39.8 98.14 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.815 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.47 -45.89 88.72 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.526 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -76.28 -24.88 54.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.456 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 107' ' ' ILE . 62.5 tp -58.96 -41.3 87.17 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.177 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.13 -42.81 99.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.855 0.359 . . . . 0.0 110.956 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 79.5 t -70.52 -43.63 77.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.294 0.569 . . . . 0.0 110.696 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 33' ' ' LEU . 7.1 mp -61.83 -38.62 88.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.199 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -60.09 -39.98 88.02 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -62.77 -44.51 95.99 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.424 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.4 mmm -69.87 -38.89 76.54 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 104.32 42.6 1.87 Allowed Glycine 0 CA--C 1.523 0.55 0 C-N-CA 119.79 -1.195 . . . . 0.0 113.291 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.726 ' HB2' ' HB3' ' A' ' 103' ' ' ALA . 26.8 p-80 -56.78 111.67 1.09 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.181 0.515 . . . . 0.0 112.355 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -85.4 -64.37 1.17 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -65.94 -35.87 81.79 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.043 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.726 ' HB3' ' HB2' ' A' ' 100' ' ' HIS . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.557 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.492 ' O ' HG22 ' A' ' 107' ' ' ILE . 87.1 mt -60.13 -40.54 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 121.205 0.526 . . . . 0.0 109.878 178.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -59.45 -48.34 82.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.561 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.5 -25.46 28.82 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.52 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.629 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 13.1 tt -61.59 -20.71 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 122.166 -0.334 . . . . 0.0 111.315 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.3 p -71.8 -10.15 59.35 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.384 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.93 -27.71 66.0 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 111.051 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.498 ' HE1' HD22 ' A' ' 25' ' ' LEU . 82.2 t80 . . . . . 0 C--N 1.331 -0.219 0 CA-C-O 120.881 0.372 . . . . 0.0 110.072 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 . . . . . 0 C--O 1.221 -0.413 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.1 m -66.88 114.98 6.14 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.747 0.308 . . . . 0.0 111.771 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.71 174.2 9.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.729 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.84 -57.63 3.56 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -72.24 -35.85 68.94 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.532 0.682 . . . . 0.0 110.808 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -111.85 69.96 0.7 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.243 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -46.34 156.02 0.52 Allowed Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.451 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.53 163.5 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 124.854 3.703 . . . . 0.0 114.635 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.77 -8.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 124.386 3.39 . . . . 0.0 115.027 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.706 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.87 -35.85 64.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.919 0.327 . . . . 0.0 110.532 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.9 tp -108.1 -78.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.55 -47.35 85.94 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -177.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.89 -52.2 49.95 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.692 -0.766 . . . . 0.0 114.988 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.447 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 32.3 tp10 -72.71 -43.7 62.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.11 -40.72 94.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.435 -0.506 . . . . 0.0 112.324 -178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 67.6 m -70.79 -43.84 67.86 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.45 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.75 -50.48 24.23 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.17 -43.38 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.584 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 84.7 mt -78.77 -15.9 57.85 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.626 -179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.4 t70 -58.77 -39.46 81.06 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.148 0.499 . . . . 0.0 110.8 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.5 m -90.53 10.03 27.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.023 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.1 t -68.13 142.43 55.76 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -137.92 57.66 1.71 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.178 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.46 -10.97 73.2 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.554 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.33 98.19 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.255 0.527 . . . . 0.0 111.019 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -126.14 -32.87 2.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.88 115.39 1.83 Allowed Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.625 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.6 p90 -54.38 -46.08 72.97 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.226 0.513 . . . . 0.0 110.846 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.404 ' HB3' HD13 ' A' ' 63' ' ' ILE . 46.9 ptt85 -83.49 -0.09 48.67 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 177.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.73 -47.65 89.19 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.297 -0.954 . . . . 0.0 113.465 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.3 mt -72.15 -42.66 65.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.055 0.427 . . . . 0.0 111.217 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.48 -39.87 92.45 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.19 -44.34 95.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.311 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 . . . . . 0 N--CA 1.465 0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.026 179.801 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 CA--C 1.531 0.231 0 CA-C-O 120.585 0.231 . . . . 0.0 111.012 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.7 t60 -73.87 -28.25 61.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.632 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.632 ' O ' ' HB3' ' A' ' 72' ' ' SER . 85.2 mt -59.54 -41.55 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 121.289 0.566 . . . . 0.0 110.32 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.473 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.9 mm-40 -67.09 -34.96 78.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 178.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.4 mttt -62.53 -49.21 76.24 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -177.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.2 mt-10 -89.47 -3.64 58.29 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -54.86 -28.7 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 118.116 0.416 . . . . 0.0 111.502 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.68 -4.73 58.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 111.179 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -106.47 22.32 16.0 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.895 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.727 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 12.01 30.72 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-O 118.567 -1.129 . . . . 0.0 113.605 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.727 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.8 tppp? 108.34 149.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.97 1.308 . . . . 0.0 112.227 177.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -134.36 -19.79 1.9 Allowed 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.495 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -60.78 -67.76 1.98 Allowed Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.605 -1.283 . . . . 0.0 111.72 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 m -88.11 -33.85 18.11 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.508 -0.407 . . . . 0.0 111.057 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -61.44 -45.74 93.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.839 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.9 tt0 -61.68 -41.57 97.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.602 0.239 . . . . 0.0 110.477 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -61.76 -46.24 90.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.533 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.5 mt -67.69 -39.23 84.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.872 0.368 . . . . 0.0 111.145 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -80.96 -4.94 56.75 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.2 m -58.45 -40.05 81.58 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -86.26 -89.61 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -86.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.121 0.486 . . . . 0.0 109.745 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -114.29 -54.64 2.57 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 18.5 ttpp -132.26 -43.9 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.6 t30 47.41 34.87 3.57 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.826 0.85 . . . . 0.0 111.703 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.449 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.29 170.79 15.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.648 -179.1 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.0 p -122.86 158.6 29.94 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.036 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.456 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -59.39 -38.18 73.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.08 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.57 98.13 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.104 -0.57 . . . . 0.0 112.756 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.22 -46.43 87.03 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.649 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.1 mm? -74.18 -24.13 59.33 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.154 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.6 tp -59.16 -37.66 77.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.061 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.0 -41.69 97.02 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.836 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.65 -23.26 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.183 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.6 mp -63.42 -41.09 98.7 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 109.843 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.77 -37.75 87.17 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.558 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -61.65 -40.52 95.2 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.68 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.4 mmt -89.42 -12.97 38.73 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.608 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.83 37.97 65.83 Favored Glycine 0 CA--C 1.52 0.401 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.748 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.474 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 19.3 t-160 -78.05 95.29 4.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.318 0.559 . . . . 0.0 110.218 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.63 -40.86 96.21 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.096 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -61.19 -39.89 91.89 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.688 0.28 . . . . 0.0 111.291 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.521 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -38.78 88.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.397 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.576 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -62.15 -42.95 97.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.953 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -63.38 -40.8 98.22 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.456 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.16 -21.77 31.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.706 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.7 tp -61.72 -21.0 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 120.696 0.284 . . . . 0.0 111.514 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.5 t -67.86 -13.94 62.55 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -74.29 -10.82 59.97 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 111.665 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 68.2 t80 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.033 0.444 . . . . 0.0 111.143 179.256 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.8 m80 . . . . . 0 C--O 1.219 -0.535 0 CA-C-O 120.262 0.077 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.508 HG23 ' HD3' ' A' ' 26' ' ' PRO . 32.4 m -76.42 122.6 24.75 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.29 166.88 20.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.438 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.5 tp -63.66 -49.81 71.76 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.84 -33.73 22.81 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.344 0.593 . . . . 0.0 111.292 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.3 72.47 0.78 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.529 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 77.2 mt -46.73 156.83 0.5 Allowed Pre-proline 0 CA--C 1.541 0.599 0 O-C-N 123.415 0.447 . . . . 0.0 111.282 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.3 Cg_exo -37.78 162.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.364 1.342 0 C-N-CA 124.877 3.718 . . . . 0.0 115.126 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -49.13 -9.35 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 124.338 3.359 . . . . 0.0 115.11 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.38 -35.02 62.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.825 0.284 . . . . 0.0 110.998 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.824 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.1 tp -108.49 -78.28 0.59 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.66 -48.44 80.79 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.9 -51.74 56.72 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.645 -0.788 . . . . 0.0 114.249 -178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -70.21 -44.03 69.47 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.403 HD21 HD21 ' A' ' 95' ' ' LEU . 96.2 mt -68.39 -39.0 81.84 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.4 p -71.82 -30.93 66.01 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.689 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.14 -56.76 3.38 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.69 -44.71 96.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.85 -18.04 61.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.607 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.447 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 12.7 t70 -58.41 -38.56 77.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 110.755 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.5 m -90.39 7.72 37.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.095 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.0 t -65.75 140.63 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.229 0.537 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -135.46 54.61 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.145 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.66 -10.58 73.8 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 115.692 -0.685 . . . . 0.0 113.607 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.52 98.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 117.255 0.528 . . . . 0.0 111.007 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -123.4 -26.63 4.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.76 114.86 0.83 Allowed Glycine 0 N--CA 1.444 -0.78 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.755 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.409 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 p90 -53.58 -46.47 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.191 0.495 . . . . 0.0 110.403 178.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.438 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.8 ptt85 -83.75 1.33 43.32 Favored 'General case' 0 C--O 1.213 -0.865 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.797 177.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.9 -44.86 94.22 Favored Glycine 0 C--O 1.23 -0.134 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.252 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.456 HD21 HD23 ' A' ' 95' ' ' LEU . 93.1 mt -72.88 -43.51 62.42 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.036 0.418 . . . . 0.0 111.194 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.763 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.37 -39.55 92.42 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.48 -42.87 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.048 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.132 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.544 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.461 0.123 0 CA-C-O 120.863 0.363 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 15.0 t60 -84.04 -18.38 37.21 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.24 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.503 ' O ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -60.41 -41.49 87.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.089 0.471 . . . . 0.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.515 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -64.64 -38.68 91.84 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 33.5 mttm -65.89 -46.15 79.43 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -177.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.98 -3.81 57.8 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.3 p -56.11 -35.59 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-N 118.18 0.446 . . . . 0.0 111.392 -179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.36 -4.62 58.0 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.966 0.412 . . . . 0.0 110.862 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -104.83 22.21 15.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.869 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.54 21.48 9.22 Favored Glycine 0 CA--C 1.52 0.375 0 C-N-CA 120.409 -0.901 . . . . 0.0 114.191 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.31 141.13 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.302 1.041 . . . . 0.0 112.004 177.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.543 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.6 t -130.73 -30.74 1.82 Allowed 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.236 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.54 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.65 -64.33 4.43 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.309 -0.948 . . . . 0.0 112.316 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.486 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 22.8 m -87.74 -38.53 15.71 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 122.725 -0.279 . . . . 0.0 111.692 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.515 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.5 ttt180 -60.54 -48.36 82.13 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.543 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -63.29 -39.68 95.24 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.772 0.32 . . . . 0.0 110.677 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.763 HD22 ' HA ' ' A' ' 50' ' ' ALA . 56.9 tp -61.08 -46.85 88.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.559 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.447 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 88.2 mt -71.31 -39.13 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.1 0.476 . . . . 0.0 111.19 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -76.25 -7.03 53.99 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -178.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.7 p -57.66 -38.94 75.94 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 m95 -87.62 -89.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.484 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -87.22 0.49 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -115.63 -52.37 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.824 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.5 ttpm? -132.25 -44.75 0.93 Allowed 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.0 t30 47.09 35.85 3.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.503 0.721 . . . . 0.0 111.307 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.32 16.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.986 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 61.9 p -119.27 155.24 32.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.462 HG23 HD11 ' A' ' 107' ' ' ILE . 1.7 mp -59.68 -39.72 80.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.608 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.93 -39.21 97.24 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.743 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.17 -45.84 89.94 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.607 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.68 -23.88 53.19 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.494 HD13 HD13 ' A' ' 107' ' ' ILE . 62.8 tp -59.01 -41.65 88.25 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.037 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.2 -41.25 98.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.606 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.17 -40.25 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.174 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.456 HD23 HD21 ' A' ' 49' ' ' LEU . 81.5 mt -61.62 -36.94 82.19 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.27 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -60.92 -39.68 90.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.854 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -63.44 -44.2 95.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.936 0.398 . . . . 0.0 110.408 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 37.4 mmt -68.87 -36.56 78.25 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.956 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.53 30.17 27.93 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.525 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.416 ' CE1' ' HB3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -74.41 97.33 3.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.147 0.498 . . . . 0.0 110.927 -179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.33 -41.66 96.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.663 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.416 ' HB3' ' CE1' ' A' ' 100' ' ' HIS . 25.8 tpp180 -62.16 -41.33 98.2 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.901 0.381 . . . . 0.0 110.872 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.51 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.93 -39.11 88.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.24 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 41.2 mm -62.41 -43.67 98.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.794 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -63.55 -42.08 98.41 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -83.93 -22.96 31.35 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.634 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.6 tt -66.09 -20.54 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 120.84 0.353 . . . . 0.0 111.429 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.1 p -70.47 -10.94 60.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.836 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -69.87 -26.33 64.14 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 0.0 110.917 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.6 t80 . . . . . 0 CA--C 1.531 0.228 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.237 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.4 m80 . . . . . 0 C--O 1.221 -0.418 0 N-CA-C 111.356 0.132 . . . . 0.0 111.356 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 t -70.37 114.14 8.2 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -163.7 175.03 10.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.6 178.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mp -80.31 -57.87 3.4 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -71.51 -36.13 70.97 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.623 0.725 . . . . 0.0 110.589 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -112.42 69.76 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.334 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD13 ' CE1' ' A' ' 110' ' ' TYR . 83.8 mt -47.14 157.46 0.5 Allowed Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.824 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -39.71 165.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 124.86 3.707 . . . . 0.0 114.182 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.85 -9.36 0.15 Allowed 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.932 3.088 . . . . 0.0 114.979 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.495 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.18 -35.29 67.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.773 0.26 . . . . 0.0 110.933 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.887 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.1 tp -107.88 -77.8 0.59 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -49.38 73.73 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -51.79 56.85 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.404 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.5 tm-20 -71.28 -43.49 67.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.496 HD13 HG21 ' A' ' 74' ' ' THR . 83.8 mt -67.86 -38.86 83.62 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -178.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.8 p -74.18 -32.1 62.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.822 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.96 -56.33 3.53 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.43 -45.25 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.8 -17.9 61.53 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.056 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.0 t70 -59.22 -37.79 78.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.979 0.419 . . . . 0.0 110.892 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.6 m -86.98 6.51 31.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.193 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.14 142.03 58.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.206 0.527 . . . . 0.0 111.458 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -131.42 46.19 2.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.155 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.12 -11.79 71.2 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.637 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.16 -43.32 98.6 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.099 0.476 . . . . 0.0 111.059 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -114.67 -24.89 8.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.296 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.76 113.96 0.26 Allowed Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.222 -178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.5 p90 -53.03 -46.01 68.24 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 117.429 0.614 . . . . 0.0 110.388 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.3 ptt85 -84.01 1.3 44.46 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.012 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.77 -50.87 60.54 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.952 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.436 HD13 HD11 ' A' ' 91' ' ' LEU . 96.5 mt -71.86 -41.87 67.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.281 0.54 . . . . 0.0 111.302 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.16 -41.52 94.6 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -59.92 -44.11 94.51 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.19 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.039 179.866 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.527 0.076 0 CA-C-O 120.886 0.374 . . . . 0.0 110.59 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -73.55 -24.95 60.18 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.287 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.555 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.19 -40.27 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.198 0.523 . . . . 0.0 110.678 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -69.77 -20.67 63.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.571 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.91 -52.49 8.77 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 3.7 mt-10 -86.48 -3.38 59.0 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.2 p -55.52 -34.81 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 117.947 0.34 . . . . 0.0 111.134 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.14 -4.59 58.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.774 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -105.12 21.94 16.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.614 -178.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.614 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.5 22.79 8.33 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 114.223 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.614 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.93 139.05 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.389 1.076 . . . . 0.0 112.17 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.555 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -131.4 -20.79 2.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.696 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.405 ' H ' ' HD3' ' A' ' 71' ' ' LYS . . . -60.65 -67.57 2.07 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.832 -1.175 . . . . 0.0 111.669 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.496 HG21 HD13 ' A' ' 33' ' ' LEU . 10.7 m -87.78 -35.03 18.09 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 122.612 -0.346 . . . . 0.0 111.573 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.2 ttt180 -60.86 -47.76 84.89 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.496 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.9 tt0 -62.5 -40.51 96.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.689 0.281 . . . . 0.0 110.908 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 50' ' ' ALA . 63.3 tp -62.0 -47.15 86.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.834 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.556 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.2 mt -71.05 -39.85 72.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.056 0.455 . . . . 0.0 111.483 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 26.2 t-105 -77.83 -6.89 55.66 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.368 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -58.59 -42.16 87.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 60.1 m95 -85.63 -89.09 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.08 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.93 -86.59 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.176 0.512 . . . . 0.0 109.725 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -113.98 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.887 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.7 ttpp -131.92 -43.97 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.005 175.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.3 t30 48.09 31.48 2.52 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.099 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.453 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.27 169.51 17.64 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 78.4 p -127.28 160.07 32.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.757 HG23 HD11 ' A' ' 107' ' ' ILE . 4.4 mm -59.44 -38.64 76.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.151 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.18 96.61 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.628 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -66.42 -43.84 84.6 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.819 0.343 . . . . 0.0 111.09 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -74.5 -29.1 61.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.42 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.05 -41.03 82.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.05 -43.19 99.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.976 0.417 . . . . 0.0 110.616 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 84.6 t -70.87 -41.17 77.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.527 0.68 . . . . 0.0 110.227 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 100' ' ' HIS . 61.0 tp -60.82 -40.95 94.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.06 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.95 -39.56 89.97 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.951 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -64.5 -43.29 94.59 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.564 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 54.0 tpp -69.25 -39.99 78.14 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.182 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.48 40.31 23.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.792 -0.718 . . . . 0.0 114.687 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.401 ' HB3' HD11 ' A' ' 95' ' ' LEU . 9.4 t60 -80.92 112.83 18.67 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.631 0.715 . . . . 0.0 110.227 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.9 mmm180 -64.06 -42.44 97.01 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -62.23 -39.67 93.58 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.1 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.46 84.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.528 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.4 mt -61.32 -43.16 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.455 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . 0.476 ' O ' HG22 ' A' ' 108' ' ' THR . 85.6 m-70 -64.84 -39.46 93.6 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.86 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -82.85 -30.42 28.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.529 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.757 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -62.54 -22.67 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 105' ' ' HIS . 6.0 t -68.77 -6.73 28.33 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -89.02 3.2 52.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 111.457 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.582 ' CE1' HD13 ' A' ' 25' ' ' LEU . 79.2 t80 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 0.0 109.989 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.1 m80 . . . . . 0 C--O 1.218 -0.601 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.3 t -81.9 119.27 23.72 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.47 172.02 19.09 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.4 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.6 tp -63.22 -50.34 70.63 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -178.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -91.48 -35.5 14.29 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.449 0.642 . . . . 0.0 110.904 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.79 71.0 1.04 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.082 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.449 HD13 ' CE1' ' A' ' 110' ' ' TYR . 93.6 mt -47.57 156.33 0.67 Allowed Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.717 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -39.33 165.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 125.068 3.846 . . . . 0.0 114.716 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.26 -8.78 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.296 3.331 . . . . 0.0 115.347 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.29 -36.4 66.12 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.118 0.417 . . . . 0.0 110.456 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.917 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -107.76 -77.93 0.59 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -52.55 65.0 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -49.45 78.41 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.684 -0.77 . . . . 0.0 114.683 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -70.94 -44.22 66.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD13 HG21 ' A' ' 74' ' ' THR . 95.7 mt -68.47 -38.89 81.48 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.649 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -74.08 -32.13 63.13 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.889 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.91 -55.25 4.05 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 66.3 t -64.51 -45.21 96.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.74 HD11 HD12 ' A' ' 49' ' ' LEU . 88.6 mt -72.75 -19.18 61.42 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.926 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.649 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 42.9 t0 -60.31 -36.12 77.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.0 m -86.11 5.76 32.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.183 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.46 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.4 t -65.36 142.19 58.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.399 0.619 . . . . 0.0 111.926 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -130.88 40.32 3.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.582 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 96.12 -15.46 62.92 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.023 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.18 97.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.931 0.365 . . . . 0.0 111.749 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.535 ' HG ' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -108.47 -22.99 12.06 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.173 0.511 . . . . 0.0 109.997 179.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.46 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.95 107.61 0.15 Allowed Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.25 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.2 p90 -52.71 -48.47 66.59 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.312 0.556 . . . . 0.0 110.31 178.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -84.17 0.01 50.35 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.599 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.44 -41.76 95.45 Favored Glycine 0 C--N 1.329 0.164 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.45 -177.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.74 HD12 HD11 ' A' ' 37' ' ' LEU . 92.7 mt -84.05 -43.02 15.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.04 0.42 . . . . 0.0 111.186 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.96 94.6 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.591 0.959 . . . . 0.0 113.591 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -60.58 -43.7 97.05 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.147 0.279 . . . . 0.0 111.302 -178.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 . . . . . 0 N--CA 1.461 0.11 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.588 179.185 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.5 t70 . . . . . 0 N--CA 1.462 0.174 0 CA-C-O 120.726 0.298 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -66.65 -26.7 67.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.917 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.533 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.53 -41.87 86.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.342 0.592 . . . . 0.0 109.914 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.492 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.38 -34.79 75.08 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.42 178.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.12 -47.7 83.44 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.596 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 61.8 mm-40 -89.36 -3.38 58.48 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -55.77 -33.59 34.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.294 0.497 . . . . 0.0 111.268 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.61 -4.61 57.74 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.899 0.38 . . . . 0.0 110.721 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -108.53 22.82 15.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.196 -178.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.636 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.74 16.04 18.65 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.169 -1.015 . . . . 0.0 114.734 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.636 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 97.83 143.73 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.491 1.116 . . . . 0.0 111.975 177.26 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.2 t -132.09 -27.81 1.79 Allowed 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.495 178.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.34 2.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 119.962 -1.113 . . . . 0.0 112.204 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 33' ' ' LEU . 21.8 m -87.24 -35.96 18.21 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.774 -0.251 . . . . 0.0 111.535 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -60.57 -46.73 89.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.874 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.52 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.4 tt0 -62.08 -42.81 99.59 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.476 0.179 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 tp -61.57 -46.42 89.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.463 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.642 HD22 ' HG3' ' A' ' 84' ' ' LYS . 98.3 mt -67.33 -39.54 85.83 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.486 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -80.26 -5.54 56.39 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.5 m -59.07 -40.01 83.87 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -86.4 -90.61 0.11 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.18 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.33 -87.28 0.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 109.717 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -110.47 -56.91 2.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.917 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.4 ttpp -132.5 -43.36 0.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.206 176.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 48.51 34.32 4.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.891 0.876 . . . . 0.0 111.883 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.489 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.22 169.3 18.03 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.2 p -125.28 158.62 33.69 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.717 179.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.87 -40.06 81.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.792 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.5 -40.17 98.32 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.733 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.27 -40.79 96.7 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.634 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.259 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.16 -40.1 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.113 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -61.7 -41.35 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.906 0.384 . . . . 0.0 110.482 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.2 t -69.32 -41.17 80.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.282 0.563 . . . . 0.0 110.022 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -59.06 -36.85 75.74 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.704 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.84 -39.35 94.12 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.353 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -61.9 -47.37 85.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.65 0.262 . . . . 0.0 110.657 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.2 mmm -71.21 -36.22 71.79 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.36 33.06 36.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.331 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.535 ' NE2' ' HG ' ' A' ' 44' ' ' LEU . 32.9 t-80 -66.8 108.25 2.46 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.524 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -63.75 -44.74 92.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -64.39 -41.4 96.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.006 0.432 . . . . 0.0 111.044 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.518 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.91 -40.3 92.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.806 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.6 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -62.72 -45.1 99.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.99 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -65.96 -40.54 91.38 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -83.03 -22.37 33.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.6 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.9 tp -66.41 -20.79 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.753 0.311 . . . . 0.0 111.161 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.3 p -70.5 -10.25 58.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.934 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -69.92 -26.24 64.05 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.865 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.449 ' CE1' HD13 ' A' ' 25' ' ' LEU . 82.1 t80 . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.266 179.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 . . . . . 0 C--O 1.221 -0.414 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -72.1 121.0 18.51 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.19 160.35 11.61 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.0 tp -65.85 -51.03 62.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -76.09 -36.73 58.82 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.457 0.646 . . . . 0.0 111.242 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.88 70.9 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.836 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -45.43 154.43 0.51 Allowed Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 123.869 0.731 . . . . 0.0 111.848 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -38.04 163.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 125.12 3.88 . . . . 0.0 115.075 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_exo -48.76 -9.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.415 3.41 . . . . 0.0 115.177 -178.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.777 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -53.86 -35.29 61.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.784 0.265 . . . . 0.0 110.5 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.83 HD23 ' HD2' ' A' ' 84' ' ' LYS . 3.0 tp -108.03 -77.3 0.6 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.197 0.444 . . . . 0.0 112.197 178.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -53.98 51.54 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.68 -51.75 57.12 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.63 -0.795 . . . . 0.0 115.045 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.5 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 35.8 tp10 -71.3 -43.06 67.82 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.44 -39.32 85.38 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.631 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.4 p -71.46 -29.2 64.58 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.474 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.55 -55.8 3.82 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.406 HG21 ' HG2' ' A' ' 102' ' ' ARG . 54.8 t -64.14 -44.93 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.527 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 88.6 mt -77.56 -16.8 58.42 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 122.068 -0.395 . . . . 0.0 111.846 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.631 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 32.5 t70 -59.34 -39.59 83.65 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.134 0.493 . . . . 0.0 110.556 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -93.27 11.42 28.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.003 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 t -67.86 144.68 55.19 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.015 0.436 . . . . 0.0 111.199 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -136.59 54.89 1.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.92 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.07 -12.94 68.85 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.035 -0.602 . . . . 0.0 114.095 178.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.99 98.75 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.564 0.682 . . . . 0.0 110.894 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -125.38 -30.63 3.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.569 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.5 117.3 0.74 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.237 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.451 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 27.6 p90 -56.24 -42.81 77.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 117.043 0.421 . . . . 0.0 110.743 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.604 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.27 -0.35 52.01 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.671 178.193 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.87 -45.65 94.72 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.548 -0.834 . . . . 0.0 113.235 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.5 mt -72.21 -43.32 64.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.887 0.343 . . . . 0.0 111.262 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.772 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.4 -41.64 93.45 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -61.71 -43.79 98.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.305 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 . . . . . 0 C--N 1.332 -0.192 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.612 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 . . . . . 0 N--CA 1.463 0.205 0 CA-C-O 120.927 0.394 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -76.29 -24.07 54.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.719 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.604 HD13 ' HB3' ' A' ' 47' ' ' ARG . 79.0 mt -59.85 -43.6 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.124 0.488 . . . . 0.0 110.294 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -67.39 -36.24 80.9 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.931 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.85 -49.06 76.38 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.9 mt-10 -90.08 -4.17 57.51 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.521 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.2 p -56.44 -33.71 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.364 0.529 . . . . 0.0 111.226 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.38 -4.25 58.12 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 110.803 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -106.97 22.13 16.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.026 -178.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.665 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.41 20.94 9.7 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.275 -0.964 . . . . 0.0 114.124 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.665 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.2 tppp? 95.72 147.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.447 1.099 . . . . 0.0 112.082 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.5 t -138.29 -30.91 0.77 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.54 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -52.88 -66.95 2.36 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.279 -0.963 . . . . 0.0 112.708 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.3 m -87.8 -34.45 18.28 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 122.441 -0.447 . . . . 0.0 111.113 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -60.9 -48.37 82.12 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.812 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.0 tt0 -63.15 -41.19 99.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.641 0.258 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.772 HD22 ' HA ' ' A' ' 50' ' ' ALA . 62.2 tp -60.89 -47.23 87.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.6 mt -70.34 -38.51 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.113 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -76.64 -6.62 52.83 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 64.6 m -58.87 -40.29 83.92 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -86.5 -90.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.786 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.26 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.41 -55.98 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.83 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.2 ttpm? -132.31 -43.75 0.94 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.1 t30 47.76 36.02 5.3 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.752 0.821 . . . . 0.0 111.269 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.0 170.85 15.23 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.802 -178.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.5 p -117.99 155.38 30.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.037 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.14 -39.3 78.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.873 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.8 -39.02 97.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.027 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -62.26 -46.63 87.95 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.604 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -75.98 -23.88 55.35 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.178 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.21 -39.46 82.72 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.027 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 53.3 mt-30 -61.22 -42.16 98.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.04 0.448 . . . . 0.0 110.47 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 99.7 t -71.75 -40.15 69.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.391 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 86.2 mt -61.64 -41.08 97.01 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.209 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 16.6 pt20 -68.67 -28.14 66.61 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.41 -48.83 73.89 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 88.7 mmm -71.76 -36.72 70.47 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.437 178.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.48 40.41 3.43 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.947 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -73.87 88.57 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.987 0.422 . . . . 0.0 111.578 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 19.4 mmt85 -62.76 -43.25 99.28 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HG2' HG21 ' A' ' 36' ' ' VAL . 7.3 tpm_? -63.22 -40.01 96.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.819 0.342 . . . . 0.0 111.106 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.78 -38.27 87.42 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.602 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.591 ' O ' HG22 ' A' ' 107' ' ' ILE . 94.6 mt -61.39 -44.29 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -65.08 -40.78 95.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.581 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.5 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -81.07 -22.39 39.26 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.502 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.777 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.5 tp -63.18 -20.97 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.863 0.363 . . . . 0.0 111.08 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.8 p -73.02 -13.18 61.17 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.621 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -74.33 -10.03 59.18 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.628 ' HE1' HD22 ' A' ' 25' ' ' LEU . 87.9 t80 . . . . . 0 CA--C 1.53 0.192 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.3 m80 . . . . . 0 C--O 1.22 -0.462 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.457 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.5 m -78.68 113.38 16.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.387 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' THR . 26.8 mt -154.8 170.61 21.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.76 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.3 tp -63.24 -50.46 70.11 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -92.01 -35.99 13.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.09 0.471 . . . . 0.0 111.583 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.65 70.78 0.88 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.1 mt -45.09 158.84 0.28 Allowed Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.923 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' HG23 ' A' ' 20' ' ' THR . 2.4 Cg_endo -39.96 165.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 124.67 3.58 . . . . 0.0 114.546 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -48.88 -8.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.038 3.159 . . . . 0.0 114.919 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.49 -36.82 67.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 117.867 0.303 . . . . 0.0 110.273 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.963 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.1 tp -107.8 -78.27 0.59 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tt -60.32 -48.54 81.29 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.96 -51.09 59.47 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.331 -0.938 . . . . 0.0 114.436 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.05 -43.3 68.1 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.3 mt -67.36 -37.95 84.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -75.0 -31.97 61.54 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.652 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.51 -58.46 2.66 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.32 -44.8 99.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.467 HD21 ' CD2' ' A' ' 100' ' ' HIS . 76.1 mt -71.91 -19.55 61.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.528 -178.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 28.2 t0 -61.7 -38.28 87.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.123 0.487 . . . . 0.0 110.591 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.3 p -87.35 1.68 52.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.012 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.9 t -66.89 142.55 57.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.267 0.556 . . . . 0.0 111.634 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -131.51 50.07 2.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.468 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.8 -12.78 68.78 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.821 -0.627 . . . . 0.0 113.65 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.44 98.68 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.159 0.504 . . . . 0.0 111.097 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.1 mt -116.16 -29.41 6.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.51 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.81 107.9 0.55 Allowed Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.241 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.547 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 33.1 p90 -53.81 -44.99 70.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.988 0.394 . . . . 0.0 110.671 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.625 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -85.31 -0.51 54.98 Favored 'General case' 0 C--O 1.219 -0.541 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 178.277 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.98 -47.36 91.1 Favored Glycine 0 C--N 1.329 0.166 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.076 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HG21 ' A' ' 74' ' ' THR . 88.8 mt -72.55 -42.13 65.0 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.858 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.31 -42.54 99.03 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.12 -42.04 99.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.092 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.231 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.98 179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.461 0.109 0 CA-C-O 121.153 0.502 . . . . 0.0 109.777 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -80.16 -23.85 40.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.283 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.625 HD13 ' HB3' ' A' ' 47' ' ' ARG . 80.3 mt -57.96 -44.57 87.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-O 120.616 0.246 . . . . 0.0 111.019 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.527 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -67.36 -37.34 83.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.132 0.491 . . . . 0.0 110.838 178.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.42 -50.27 68.23 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.593 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 52.5 mm-40 -89.75 -5.34 57.07 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.527 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.5 p -57.93 -32.79 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-N 118.266 0.485 . . . . 0.0 111.065 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.8 -4.93 58.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.866 0.365 . . . . 0.0 110.516 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -104.78 21.41 16.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.781 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.8 11.18 33.28 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-O 118.407 -1.218 . . . . 0.0 114.976 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.5 OUTLIER 112.17 141.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.047 1.339 . . . . 0.0 111.624 177.34 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.8 t -128.54 -35.7 1.92 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.797 178.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -49.43 -62.11 5.01 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.847 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.514 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -89.55 -43.06 11.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.531 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 75.8 ttt180 -61.77 -47.63 84.29 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' A' ' 72' ' ' SER . 50.3 tp10 -61.88 -43.67 98.38 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.3 -0.16 . . . . 0.0 111.308 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.78 -44.12 94.32 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.599 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.3 mt -64.62 -39.67 94.13 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.928 0.394 . . . . 0.0 111.057 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -82.13 -6.36 59.13 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.7 m -59.77 -39.48 85.01 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -85.79 -90.67 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.39 -86.33 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.346 0.593 . . . . 0.0 110.018 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -113.25 -57.07 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.963 ' HD2' HD23 ' A' ' 29' ' ' LEU . 14.9 ttpp -132.12 -42.59 0.98 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.6 t30 49.1 33.62 5.01 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.652 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.519 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.65 167.8 21.28 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.5 p -127.23 158.86 36.03 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.67 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.19 -41.95 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.373 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -40.21 98.6 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.72 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.24 -45.62 87.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.771 0.32 . . . . 0.0 111.762 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.617 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.1 -24.69 55.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.63 -179.653 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' A' ' 95' ' ' LEU . 61.7 tp -59.15 -41.36 88.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.349 -179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.39 -41.59 98.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.138 0.495 . . . . 0.0 110.427 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.405 HG12 ' CD2' ' A' ' 49' ' ' LEU . 85.5 t -70.42 -39.86 76.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.416 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 90.6 mt -61.13 -40.26 93.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.608 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.93 -40.34 96.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.942 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.16 -48.03 81.88 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.38 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -71.11 -37.64 72.36 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.8 40.07 2.99 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.206 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.467 ' CD2' HD21 ' A' ' 37' ' ' LEU . 37.4 m80 -78.32 83.41 4.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -63.31 -41.46 98.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.144 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.3 tpp180 -63.53 -40.92 98.29 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 110.755 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.56 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.11 -39.23 89.2 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.484 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.596 ' O ' HG22 ' A' ' 107' ' ' ILE . 43.1 mm -62.58 -43.63 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.402 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -61.1 -48.2 82.76 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.788 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 mp -80.39 -21.26 42.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -62.53 -21.23 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-O 120.871 0.367 . . . . 0.0 111.082 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.1 m -62.78 -14.46 45.38 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.772 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.65 -26.26 64.31 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.551 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.276 179.319 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 120.4 0.143 . . . . 0.0 111.139 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.6 m -69.13 119.73 13.87 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.62 176.52 7.19 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.454 178.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.94 -58.03 3.36 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -72.66 -35.69 67.77 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.536 0.684 . . . . 0.0 110.813 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -112.25 70.56 0.72 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.849 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.479 HD22 ' HE1' ' A' ' 110' ' ' TYR . 98.5 mt -48.09 158.03 0.6 Allowed Pre-proline 0 CA--C 1.538 0.486 0 O-C-N 123.802 0.689 . . . . 0.0 111.589 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -38.77 165.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 124.987 3.792 . . . . 0.0 114.622 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -50.29 -9.34 0.17 Allowed 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 123.874 3.049 . . . . 0.0 114.812 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.19 -36.15 68.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.575 0.171 . . . . 0.0 110.546 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.937 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.4 tp -108.25 -78.93 0.58 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.17 -0.612 . . . . 0.0 112.562 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.34 -48.6 80.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.8 -52.35 53.5 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.525 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -72.37 -43.4 64.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 74' ' ' THR . 96.0 mt -67.5 -38.55 84.49 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -77.09 -33.0 57.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.101 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.57 -56.8 3.33 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.456 HG11 ' HG2' ' A' ' 102' ' ' ARG . 63.1 t -64.25 -45.07 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -177.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.628 HD13 HD11 ' A' ' 49' ' ' LEU . 53.0 mt -73.45 -17.62 61.22 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.152 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.6 t70 -59.41 -37.09 77.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 0.0 110.671 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.6 p -84.85 4.58 32.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.405 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 53.9 t -61.91 141.33 58.06 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.329 0.585 . . . . 0.0 112.005 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -132.36 45.94 2.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.89 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.86 -12.01 70.03 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.282 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.67 98.67 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.451 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.14 -23.49 8.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.018 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.405 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.73 109.86 0.25 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.957 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -53.06 -47.89 68.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.168 0.484 . . . . 0.0 110.532 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.34 2.3 36.94 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.02 -37.41 71.07 Favored Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.03 -177.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.628 HD11 HD13 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -82.19 -45.22 15.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.65 0.262 . . . . 0.0 110.832 179.503 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -61.84 -38.07 86.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.717 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.78 -43.4 94.39 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.157 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.379 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.187 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 121.041 0.448 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -74.39 -25.99 59.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.661 179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.526 HG21 ' HB3' ' A' ' 47' ' ' ARG . 83.1 mt -59.81 -43.71 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 109.975 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.8 mt-10 -67.85 -36.15 79.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.135 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.81 -49.07 76.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.99 -4.04 57.66 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -56.67 -33.9 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 118.239 0.472 . . . . 0.0 111.12 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.54 -4.24 57.98 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.847 0.356 . . . . 0.0 110.733 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -106.15 21.99 16.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.015 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.568 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.29 21.74 9.18 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.269 -0.967 . . . . 0.0 114.281 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 94.37 141.83 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.36 1.064 . . . . 0.0 112.175 177.342 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.553 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.3 t -132.31 -29.9 1.56 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.078 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.582 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.58 -54.15 40.15 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 119.865 -1.159 . . . . 0.0 112.269 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.658 HG21 ' HB3' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -91.5 -43.4 9.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.149 0.499 . . . . 0.0 111.872 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.534 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.4 ttt180 -60.13 -47.58 85.33 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.548 -177.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.7 tt0 -62.59 -41.13 98.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.754 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.658 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.19 -46.59 89.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.686 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.573 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.5 mt -71.61 -38.95 70.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.148 0.499 . . . . 0.0 111.014 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -75.32 -6.26 48.97 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -58.24 -40.35 81.5 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -86.77 -89.96 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.792 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -112.36 -55.79 2.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.937 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.74 -44.58 0.89 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.604 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.3 t30 47.66 35.87 4.94 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.941 178.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 167.9 21.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.8 p -117.51 157.58 26.04 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.396 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.42 -39.44 79.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.431 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.47 99.27 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 120.902 -0.665 . . . . 0.0 112.981 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.04 -40.84 97.21 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.624 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.79 -24.34 36.0 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.128 -179.715 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.66 -41.94 91.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.14 -41.33 98.15 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.445 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -66.73 -41.85 88.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.216 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 93.2 mt -61.62 -40.88 96.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.844 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -65.03 -39.59 93.57 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.527 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -61.81 -48.83 78.84 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.44 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 15.3 tpt -72.53 -39.82 67.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.8 40.35 2.02 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.987 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . 0.475 ' O ' HG12 ' A' ' 104' ' ' ILE . 77.4 m80 -78.38 87.68 4.4 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.718 0.294 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.64 -42.85 99.83 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . 0.456 ' HG2' HG11 ' A' ' 36' ' ' VAL . 25.4 tpp180 -63.45 -41.08 98.64 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.125 0.488 . . . . 0.0 110.913 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.415 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.09 -38.12 85.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.646 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 40.3 mm -61.29 -44.19 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.674 179.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -64.7 -41.21 96.17 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.621 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -79.35 -23.04 43.65 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.47 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.2 tp -63.87 -21.14 28.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.92 0.391 . . . . 0.0 111.425 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -75.48 -9.46 58.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.75 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -89.21 5.05 46.54 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.479 ' HE1' HD22 ' A' ' 25' ' ' LEU . 60.2 t80 . . . . . 0 N--CA 1.466 0.362 0 CA-C-O 120.63 0.252 . . . . 0.0 111.141 178.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.51 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 79.7 m80 . . . . . 0 C--O 1.223 -0.293 0 N-CA-C 111.69 0.255 . . . . 0.0 111.69 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.591 HG23 ' HD3' ' A' ' 26' ' ' PRO . 77.7 m -77.74 120.07 22.13 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.59 170.51 21.33 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.029 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.6 -50.4 69.56 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -91.53 -35.0 14.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.363 0.602 . . . . 0.0 111.319 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.57 71.58 1.09 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.879 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.9 mt -44.7 156.95 0.33 Allowed Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.935 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.591 ' HD3' HG23 ' A' ' 20' ' ' THR . 4.1 Cg_exo -39.33 164.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 124.999 3.799 . . . . 0.0 114.488 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.51 ' HD3' ' HB2' ' A' ' 19' ' ' HIS . 9.6 Cg_endo -54.65 -7.72 0.98 Allowed 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.643 2.895 . . . . 0.0 113.973 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.43 -35.53 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.734 HD23 ' HD3' ' A' ' 84' ' ' LYS . 2.9 tp -105.7 -78.07 0.58 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.044 178.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.431 ' H ' ' HE3' ' A' ' 84' ' ' LYS . 61.7 tp -63.08 -46.04 89.31 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . 0.461 ' H ' ' HA ' ' A' ' 27' ' ' PRO . . . -60.01 -54.32 38.39 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.633 -0.794 . . . . 0.0 114.797 -177.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.7 tm-20 -73.2 -42.81 62.25 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 95.9 mt -67.6 -37.89 83.2 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 13.7 p -78.98 -32.48 45.27 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.883 -179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.31 -55.62 3.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.93 -44.58 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 80.9 mt -72.62 -19.27 61.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.249 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.2 t0 -60.49 -36.81 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.88 0.371 . . . . 0.0 110.829 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.1 m -86.01 5.14 34.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.108 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 52.0 t -65.33 141.94 58.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.291 0.567 . . . . 0.0 111.629 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -130.0 43.72 3.08 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.891 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.06 -12.5 69.07 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.402 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.3 97.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.037 0.418 . . . . 0.0 111.4 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.75 -23.38 10.65 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.649 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.41 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 78.41 109.9 0.19 Allowed Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.738 -178.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -52.73 -48.61 66.58 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 117.315 0.558 . . . . 0.0 110.674 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -83.74 1.28 43.49 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.576 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.67 -43.18 94.5 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.086 -178.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.2 mt -80.41 -41.58 24.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.029 0.415 . . . . 0.0 111.088 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.536 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -63.64 -41.68 98.21 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -60.18 -46.2 90.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.303 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 . . . . . 0 N--CA 1.463 0.194 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.943 179.443 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 . . . . . 0 CA--C 1.523 -0.06 0 CA-C-O 120.608 0.242 . . . . 0.0 110.879 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.578 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 8.3 p-80 -78.5 -20.08 51.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.446 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.535 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 79.6 mt -62.23 -42.22 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.461 0.648 . . . . 0.0 110.068 178.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.568 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.0 mm-40 -69.54 -33.4 72.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.756 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.3 mttt -62.86 -48.3 79.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.584 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 57.3 mm-40 -89.81 -4.33 57.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.668 -0.645 . . . . 0.0 112.739 -178.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.3 p -57.38 -33.3 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.161 0.437 . . . . 0.0 111.173 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.27 -4.63 58.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.939 0.4 . . . . 0.0 110.571 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -107.13 22.45 15.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.059 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.65 13.4 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.257 -0.973 . . . . 0.0 114.595 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 102.21 144.67 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.858 1.263 . . . . 0.0 111.916 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.9 t -130.7 -31.61 1.75 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.195 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.502 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.21 -63.35 5.25 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.841 -1.171 . . . . 0.0 111.546 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.449 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -89.08 -39.91 13.31 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 59.1 ttt85 -62.37 -48.7 78.59 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.1 tp10 -63.43 -39.71 95.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.5 tp -61.05 -45.98 92.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.28 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 83.9 mt -69.51 -39.32 77.64 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.945 0.402 . . . . 0.0 110.979 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -77.01 -5.78 50.06 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.8 m -58.53 -40.15 82.15 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -86.42 -89.66 0.11 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.735 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.7 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -114.37 -55.01 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.734 ' HD3' HD23 ' A' ' 29' ' ' LEU . 1.2 ttmp? -132.05 -44.66 0.95 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 175.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 46.03 36.88 3.3 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.918 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 161.91 36.1 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.0 p -115.33 155.2 27.77 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.509 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.4 mp -60.56 -38.52 78.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.12 -179.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.517 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.47 -39.83 97.84 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.581 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.32 -45.3 91.95 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.636 0.255 . . . . 0.0 111.644 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -72.51 -26.0 61.61 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.832 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.746 HD21 HG12 ' A' ' 107' ' ' ILE . 53.6 mt -59.54 -38.22 80.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -61.79 -42.17 98.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.037 0.446 . . . . 0.0 109.998 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 91.1 t -70.72 -41.22 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.352 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.5 mp -59.01 -38.7 79.84 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.612 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.51 -40.24 96.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.867 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.53 -41.99 92.47 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.4 tpt -70.99 -38.73 72.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.419 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.0 30.19 35.7 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.177 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -79.36 107.43 12.11 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.044 0.449 . . . . 0.0 110.649 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.95 -41.45 95.48 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -61.33 -40.52 94.53 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.234 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.435 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.99 -39.74 90.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.5 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.594 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -63.12 -43.89 99.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.014 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -64.48 -41.42 96.5 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.523 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -80.87 -22.04 40.18 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.746 HG12 HD21 ' A' ' 92' ' ' LEU . 1.8 tp -62.04 -20.36 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 70.3 p -72.07 -11.26 60.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.639 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -83.49 15.98 2.82 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.887 0.375 . . . . 0.0 111.471 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' TYR . . . . . 0.508 ' CD1' HD13 ' A' ' 88' ' ' ILE . 63.4 t80 . . . . . 0 C--N 1.331 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 110.814 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.99 0.424 . . . . 0.0 110.9 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -73.37 137.9 44.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.785 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 58.56 33.24 22.95 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.758 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -86.1 -177.81 49.91 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.403 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.5 m -117.57 139.62 50.72 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.733 0.301 . . . . 0.0 110.7 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.404 ' HG3' ' OE1' ' A' ' 69' ' ' GLN . 22.8 ptp -157.39 163.98 38.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.439 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -128.12 144.9 51.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.35 . . . . 0.0 111.593 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 152.08 54.79 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 116.013 -0.54 . . . . 0.0 112.033 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.3 114.69 28.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.539 0.209 . . . . 0.0 111.387 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 30.1 p -149.42 162.27 40.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.696 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 177.52 179.89 47.91 Favored Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 121.108 -0.567 . . . . 0.0 111.801 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.08 145.41 28.41 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.968 0.384 . . . . 0.0 111.394 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 43.1 ttp180 -159.12 146.66 17.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -175.13 -175.87 42.94 Favored Glycine 0 N--CA 1.454 -0.137 0 C-N-CA 120.213 -0.994 . . . . 0.0 112.724 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.75 -39.89 93.21 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 121.023 0.44 . . . . 0.0 111.113 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -92.66 139.89 30.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.0 p -84.59 109.16 17.76 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.202 0.525 . . . . 0.0 111.467 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.86 -7.92 50.91 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.723 179.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m80 -103.82 21.84 15.57 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.228 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.491 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.3 m -75.02 113.5 12.42 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 20' ' ' THR . 20.5 mt -159.81 162.14 34.7 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.64 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 63.2 tp -63.87 -50.04 70.39 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -81.62 -35.77 29.69 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.291 0.567 . . . . 0.0 111.792 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -112.56 71.01 0.73 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.679 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.5 mt -44.68 156.92 0.33 Allowed Pre-proline 0 CA--C 1.538 0.481 0 O-C-N 124.009 0.818 . . . . 0.0 111.955 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -39.03 165.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.255 0 C-N-CA 125.09 3.86 . . . . 0.0 114.849 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -50.06 -8.95 0.14 Allowed 'Trans proline' 0 C--N 1.362 1.274 0 C-N-CA 124.061 3.174 . . . . 0.0 114.906 -178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.548 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.92 -36.04 67.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.68 0.218 . . . . 0.0 110.673 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.7 tp -107.82 -78.65 0.58 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.23 -0.588 . . . . 0.0 112.529 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.445 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.6 OUTLIER -61.87 -49.1 77.61 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.27 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.59 -51.6 58.11 Favored Glycine 0 CA--C 1.525 0.67 0 C-N-CA 120.405 -0.902 . . . . 0.0 114.535 -177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.444 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.4 tm-20 -72.67 -43.77 62.68 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.2 mt -66.35 -38.94 88.77 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.9 p -75.21 -31.95 61.05 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.032 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.27 -55.95 3.77 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.4 t -64.47 -45.21 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.03 -18.59 61.94 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.06 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 16.9 t70 -59.96 -38.07 81.44 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.987 0.422 . . . . 0.0 110.772 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 93.4 p -83.3 3.02 33.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.444 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 48.3 t -62.37 141.53 58.27 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.402 0.62 . . . . 0.0 112.186 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -133.33 46.37 2.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.642 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.56 -12.86 68.25 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.462 -0.79 . . . . 0.0 113.177 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.71 98.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.964 0.382 . . . . 0.0 111.549 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -115.29 -25.2 8.1 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.174 179.174 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 80.14 107.58 0.27 Allowed Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.455 -0.793 . . . . 0.0 112.002 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 12.3 p90 -53.32 -46.0 69.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 117.244 0.522 . . . . 0.0 111.078 178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.4 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.5 ptt180 -82.97 1.69 38.54 Favored 'General case' 0 C--O 1.212 -0.915 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.872 178.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.32 -44.13 93.53 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.323 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.3 mt -73.55 -43.77 59.1 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 117.182 0.491 . . . . 0.0 111.211 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.78 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.67 -39.51 93.81 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.62 -42.62 97.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.795 -178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -42.67 99.62 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.473 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 1.005 HD23 HD11 ' A' ' 77' ' ' LEU . 51.5 tp -68.39 -39.95 81.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.2 m 59.36 52.09 6.2 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.186 -0.461 . . . . 0.0 112.139 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 80.9 p -63.83 -37.96 89.33 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.801 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -156.41 146.67 21.4 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.728 0.299 . . . . 0.0 110.641 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 49.1 m0 -70.56 -31.2 68.15 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.43 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.7 mt -88.78 0.5 56.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.548 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.409 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.0 t70 -61.3 -38.56 87.25 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.654 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.832 ' HA ' HD12 ' A' ' 63' ' ' ILE . 28.1 m -60.52 -27.47 40.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.37 -45.51 90.8 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.089 0.471 . . . . 0.0 110.698 179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.47 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -76.13 -21.54 56.49 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.507 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.832 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.4 mt -59.47 -42.22 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 121.093 0.473 . . . . 0.0 110.632 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.456 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -66.51 -35.17 79.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.97 0.414 . . . . 0.0 110.946 178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.47 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.8 mttt -63.02 -49.57 74.12 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -177.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 7.5 mt-10 -89.74 -2.95 58.38 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.5 p -54.51 -32.65 25.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-N 118.423 0.556 . . . . 0.0 111.432 -179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.12 -4.73 58.21 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.793 0.33 . . . . 0.0 111.007 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.404 ' OE1' ' HG3' ' A' ' 6' ' ' MET . 28.8 mm100 -106.48 22.47 15.77 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.105 -178.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.629 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.92 19.22 12.15 Favored Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.101 -1.047 . . . . 0.0 114.131 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 96.5 142.64 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.337 1.055 . . . . 0.0 111.862 177.594 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.563 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.5 t -131.0 -26.42 2.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.388 178.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.58 -64.58 4.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.095 -1.05 . . . . 0.0 111.892 179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 19.7 m -88.32 -38.48 15.13 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 111.694 179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.3 ttt-85 -60.37 -47.75 84.71 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -177.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.563 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.5 tt0 -63.21 -40.35 97.24 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.758 0.313 . . . . 0.0 110.866 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 1.005 HD11 HD23 ' A' ' 53' ' ' LEU . 59.0 tp -61.1 -46.45 90.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.65 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.495 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.2 mt -70.5 -38.58 74.34 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 121.109 0.481 . . . . 0.0 110.778 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -75.7 -6.73 51.94 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.685 -179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.8 m -58.65 -40.13 82.57 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -86.26 -89.57 0.11 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.788 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.59 -86.25 0.5 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -114.13 -54.83 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.9 ttpp -132.66 -44.2 0.9 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.437 175.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.7 t30 47.76 35.78 5.04 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.753 0.821 . . . . 0.0 111.815 178.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.25 171.08 14.81 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.921 -179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -121.21 157.96 29.11 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.73 -39.09 78.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.113 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.69 -39.72 98.28 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 121.071 -0.585 . . . . 0.0 112.774 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.35 -45.52 90.82 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.606 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.54 -23.98 45.91 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.393 -179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.6 tp -59.36 -40.64 87.1 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.673 0.273 . . . . 0.0 110.724 -179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -62.24 -41.53 98.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.299 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 97.7 t -69.56 -41.11 80.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.0 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.2 mp -59.84 -41.12 90.68 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.826 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.61 -40.51 97.09 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.073 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -62.78 -46.18 89.21 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.823 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.3 mmm -70.09 -37.34 75.38 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.775 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 93.48 38.51 5.28 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.383 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.476 ' NE2' ' HB3' ' A' ' 44' ' ' LEU . 39.4 m170 -79.98 91.71 5.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.928 0.394 . . . . 0.0 110.631 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -62.9 -42.08 99.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.9 tpt85 -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.02 0.438 . . . . 0.0 110.647 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.24 -38.91 88.36 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.731 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 45.1 mm -62.78 -39.56 85.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.863 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -60.25 -48.0 83.61 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.222 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.444 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -80.71 -22.04 40.68 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -178.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 3.1 tp -60.66 -20.66 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 120.871 0.367 . . . . 0.0 111.424 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.2 p -71.94 -12.22 61.15 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.609 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -69.25 -27.18 65.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.189 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -60.34 -47.63 85.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.891 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 102.47 154.95 25.4 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.924 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -110.81 7.0 21.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.679 0.276 . . . . 0.0 111.51 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.8 p -138.56 142.87 33.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.8 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 4.6 mp 62.1 29.3 17.55 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.695 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 79.2 p -81.47 151.23 68.51 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.179 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.01 62.46 8.49 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.777 2.318 . . . . 0.0 112.598 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 58.9 m -127.47 147.13 50.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.917 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -127.29 146.24 50.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.472 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -63.14 -39.67 95.34 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.518 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 45.4 m 61.5 35.8 17.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.781 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 18.3 m-85 -111.12 27.36 9.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.096 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -116.29 142.38 46.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.687 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -125.41 146.86 49.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.572 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.134 -1.37 . . . . 0.0 112.23 179.986 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.032 0.444 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -104.19 119.28 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -102.72 1.89 35.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.188 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 76.17 -159.13 50.15 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.797 -0.715 . . . . 0.0 112.403 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.4 m 57.73 42.1 24.14 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.699 0.4 . . . . 0.0 111.888 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 25.7 mmt -104.45 139.03 39.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.567 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.56 154.68 41.01 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.042 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 92.2 -8.97 77.19 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 121.109 -0.567 . . . . 0.0 112.923 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -87.84 75.7 8.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.812 0.339 . . . . 0.0 110.604 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 30.7 p -157.75 168.14 28.07 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 96.11 164.76 33.78 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.922 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.65 148.27 30.89 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.4 tpt85 -62.82 -45.51 92.29 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.427 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 159.35 168.14 20.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.408 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.86 -39.96 94.39 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.857 0.361 . . . . 0.0 111.931 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -108.65 147.11 32.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.7 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.5 p -81.59 109.85 16.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.126 0.489 . . . . 0.0 111.212 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.29 -8.49 50.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.988 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -104.49 22.27 15.26 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.804 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.6 m -71.24 116.07 11.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.654 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.41 162.44 17.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.312 179.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -64.84 -50.46 66.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.02 -35.81 23.59 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 121.412 0.625 . . . . 0.0 111.408 -178.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -110.11 70.67 0.73 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.261 -0.881 . . . . 0.0 109.146 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.9 mt -46.35 156.18 0.51 Allowed Pre-proline 0 N--CA 1.467 0.405 0 O-C-N 124.067 0.854 . . . . 0.0 111.69 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -38.83 165.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 124.98 3.787 . . . . 0.0 114.698 -178.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.91 -8.94 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.2 3.266 . . . . 0.0 115.204 -178.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.593 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.3 -36.64 66.4 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 117.975 0.352 . . . . 0.0 110.39 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.909 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.5 tp -106.65 -78.33 0.58 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.41 HD12 ' HB2' ' A' ' 84' ' ' LYS . 0.5 OUTLIER -60.5 -51.7 68.32 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.57 -51.26 60.13 Favored Glycine 0 CA--C 1.525 0.672 0 C-N-CA 120.639 -0.791 . . . . 0.0 114.826 -177.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.498 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.3 tm-20 -70.88 -43.62 68.0 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.444 HD13 HG21 ' A' ' 74' ' ' THR . 95.4 mt -67.08 -38.8 86.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.3 p -72.19 -31.07 65.57 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 120.348 -0.541 . . . . 0.0 111.62 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.62 -55.49 3.96 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.53 -45.69 97.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.5 mt -73.11 -19.16 61.2 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.669 -0.412 . . . . 0.0 111.377 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.7 t70 -60.11 -39.16 85.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.012 0.434 . . . . 0.0 111.098 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.9 m -90.22 9.12 29.79 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.971 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 28.4 t -68.02 143.82 55.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.205 0.526 . . . . 0.0 111.695 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.32 49.51 2.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.217 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.69 -12.57 69.21 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.561 179.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.71 98.73 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.16 0.505 . . . . 0.0 111.136 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.4 mt -119.44 -26.63 5.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.722 178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.92 113.51 0.32 Allowed Glycine 0 N--CA 1.443 -0.859 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.894 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 9.6 p90 -53.29 -47.44 69.2 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 117.009 0.404 . . . . 0.0 110.473 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.9 ptt180 -84.29 1.11 46.39 Favored 'General case' 0 C--O 1.212 -0.912 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.917 177.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.69 -46.7 91.9 Favored Glycine 0 CA--C 1.517 0.199 0 C-N-CA 120.159 -1.02 . . . . 0.0 113.334 -177.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.9 mt -74.18 -42.61 59.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.017 0.408 . . . . 0.0 110.911 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.46 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.6 -40.43 96.91 Favored 'General case' 0 N--CA 1.462 0.144 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.37 -45.81 92.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.237 -178.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -68.67 -40.5 80.11 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 120.842 0.353 . . . . 0.0 111.234 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 79.0 mt -67.65 -41.45 83.79 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.193 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.4 m -143.64 136.49 27.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.708 0.29 . . . . 0.0 110.66 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.7 m -112.91 118.82 35.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.865 0.364 . . . . 0.0 111.294 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.9 t -157.83 143.01 16.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.182 179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 99.3 m95 -85.3 -15.32 43.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.477 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 91.8 mt -91.48 -31.65 15.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.727 0.298 . . . . 0.0 111.349 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -63.3 -38.38 90.95 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.306 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.781 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.9 m -62.66 -25.45 38.19 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.85 -45.87 90.58 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 121.01 0.433 . . . . 0.0 110.313 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.9 t60 -74.69 -25.08 58.92 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.962 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.7 mt -59.88 -43.4 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 121.224 0.535 . . . . 0.0 110.161 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.555 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -66.99 -36.01 81.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.175 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.69 -49.08 76.52 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.534 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -90.18 -3.78 57.66 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.6 p -56.05 -34.41 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 CA-C-N 118.271 0.487 . . . . 0.0 111.321 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.2 -4.21 58.31 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 110.813 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -105.67 21.93 16.4 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.751 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.617 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.04 21.42 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 120.362 -0.923 . . . . 0.0 114.276 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 94.91 141.56 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.319 1.047 . . . . 0.0 112.159 177.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.536 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.8 t -131.56 -29.89 1.71 Allowed 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.42 178.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -53.02 -66.98 2.35 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.241 -0.98 . . . . 0.0 112.356 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.444 HG21 HD13 ' A' ' 33' ' ' LEU . 24.9 m -87.38 -36.71 17.62 Favored 'General case' 0 C--N 1.32 -0.689 0 O-C-N 122.625 -0.338 . . . . 0.0 111.525 179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -60.77 -47.16 87.58 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 81.7 tt0 -62.11 -42.4 99.19 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.547 0.213 . . . . 0.0 111.181 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 60.0 tp -63.17 -45.62 90.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.291 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.637 HD22 ' HG3' ' A' ' 84' ' ' LYS . 97.3 mt -67.6 -40.21 84.77 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.843 0.354 . . . . 0.0 111.285 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 73.5 m95 -81.5 -5.85 58.37 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.6 t -58.99 -41.35 87.44 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.9 m95 -85.4 -89.48 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.796 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.53 -87.17 0.49 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -114.47 -54.29 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 177.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.909 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.0 ttpp -132.3 -43.51 0.94 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.4 t30 48.25 34.19 4.31 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.791 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.479 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.51 170.83 15.2 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.789 -179.385 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 63.2 p -126.45 159.13 34.21 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.375 179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.568 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.7 mp -59.7 -40.03 81.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.407 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.425 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.0 -39.49 97.14 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.546 179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -63.82 -44.23 93.85 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.665 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.8 OUTLIER -73.85 -27.58 61.16 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.736 -179.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 88' ' ' ILE . 74.6 mt -60.28 -32.83 71.56 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.542 0.21 . . . . 0.0 111.442 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -61.03 -42.52 98.63 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.479 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 15.7 m -86.3 -23.21 6.95 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 C-N-CA 121.124 -0.231 . . . . 0.0 111.411 179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.8 mp -61.9 -43.25 99.24 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.833 0.349 . . . . 0.0 110.255 178.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -65.72 -39.95 91.7 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.739 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -64.21 -43.84 93.79 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.03 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -71.75 -39.13 70.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.595 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.24 33.36 6.0 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.697 -0.763 . . . . 0.0 111.551 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -75.92 86.28 2.86 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 121.065 0.459 . . . . 0.0 111.35 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -64.84 -41.21 95.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.549 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 30.1 tpt180 -64.24 -39.86 94.82 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.487 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.549 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.71 -38.81 86.3 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.731 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.1 mt -61.47 -43.67 97.22 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.278 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -61.48 -47.66 84.67 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.245 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.498 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.1 OUTLIER -77.88 -22.46 49.75 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -179.149 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.593 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.1 tp -63.32 -19.99 25.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.773 0.321 . . . . 0.0 111.478 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 82.2 p -67.84 -12.84 61.46 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.429 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -69.83 -27.45 64.88 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.52 179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -70.61 129.39 39.05 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.91 139.89 17.39 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.494 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -84.36 -0.06 51.18 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.1 -44.28 98.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.02 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.4 mt -110.49 132.29 54.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.806 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.4 m -125.82 90.23 50.82 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.809 179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.45 65.77 7.29 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.58 2.186 . . . . 0.0 112.895 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.3 p -63.99 -34.16 77.37 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.527 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.5 mt-10 58.42 42.01 21.96 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.647 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -62.33 -39.41 92.97 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.3 m 60.64 -148.92 0.43 Allowed 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.636 0.585 . . . . 0.0 111.381 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 58.65 33.91 23.43 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.419 0.449 . . . . 0.0 111.857 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -86.17 144.01 27.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.645 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 57.9 39.62 26.58 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.51 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.223 -1.32 . . . . 0.0 112.332 -179.979 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.659 0.266 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 60.66 40.55 16.31 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.815 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -113.15 148.57 35.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.874 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.26 174.15 36.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.811 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.422 ' HA ' ' OD1' ' A' ' 41' ' ' ASP . 52.4 m -103.83 123.6 47.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.931 0.366 . . . . 0.0 111.044 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 78.8 mtm -136.69 157.42 46.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.589 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -138.79 153.81 48.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.591 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -129.64 156.76 21.53 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.58 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.8 p-10 -119.51 19.53 12.63 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.734 0.302 . . . . 0.0 111.382 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.8 m -101.26 129.89 47.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.942 0.401 . . . . 0.0 111.393 -179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -94.31 -175.35 39.0 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.346 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -133.27 147.0 51.92 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.793 0.33 . . . . 0.0 110.807 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 125.06 31.89 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.986 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -115.77 8.78 19.25 Favored Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.598 -0.811 . . . . 0.0 113.188 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -117.65 -66.53 1.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.994 0.397 . . . . 0.0 111.772 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.3 mt -108.8 144.02 37.2 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.704 -179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.3 p -90.01 110.01 21.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.906 0.384 . . . . 0.0 111.3 -179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.19 -11.27 38.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 0.0 111.086 178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -108.8 21.54 17.1 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.776 -178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 t -74.43 125.37 28.39 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -178.44 4.99 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.492 179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.05 -58.23 3.26 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 -73.92 -35.73 64.64 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.554 0.692 . . . . 0.0 110.513 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -109.91 70.28 0.72 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.732 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.611 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.6 mt -48.34 156.38 0.81 Allowed Pre-proline 0 CA--C 1.536 0.405 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.987 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -34.93 163.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.222 0 C-N-CA 125.086 3.857 . . . . 0.0 115.17 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.24 -8.72 0.09 OUTLIER 'Trans proline' 0 C--N 1.362 1.285 0 C-N-CA 124.277 3.318 . . . . 0.0 115.054 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.62 -35.56 63.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.605 0.184 . . . . 0.0 110.904 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HB3' ' A' ' 91' ' ' LEU . 6.6 tp -108.64 -79.19 0.58 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.3 tp -62.01 -47.75 83.37 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.63 -51.3 59.56 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.651 -0.785 . . . . 0.0 114.632 -177.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -70.5 -43.52 69.51 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.4 mt -66.71 -38.44 86.74 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.967 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.8 p -73.25 -31.82 64.34 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.797 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.34 -54.49 4.56 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -178.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 71.5 t -64.54 -43.99 96.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.8 mt -71.09 -18.25 62.55 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 121.008 -0.277 . . . . 0.0 111.419 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.512 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 5.7 t70 -59.58 -37.81 79.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.139 0.495 . . . . 0.0 110.661 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.1 m -86.75 7.39 26.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.849 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.44 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.9 t -65.54 140.01 58.52 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-O 121.345 0.593 . . . . 0.0 111.746 -179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.422 ' OD1' ' HA ' ' A' ' 5' ' ' SER . 24.3 t0 -131.42 44.06 2.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.454 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.59 -10.91 72.21 Favored Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.392 -0.822 . . . . 0.0 113.017 -179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.19 97.71 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.905 0.352 . . . . 0.0 111.562 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -116.24 -22.19 8.98 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.354 -0.609 . . . . 0.0 109.354 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.44 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.53 113.72 0.25 Allowed Glycine 0 N--CA 1.445 -0.734 0 CA-C-N 115.056 -0.974 . . . . 0.0 111.764 -178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.9 p90 -52.37 -49.2 64.85 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.284 0.542 . . . . 0.0 109.925 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.455 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.6 ptt180 -83.93 1.38 43.73 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.562 177.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.11 -45.62 92.33 Favored Glycine 0 CA--C 1.516 0.129 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.437 -177.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.409 HD22 HD12 ' A' ' 95' ' ' LEU . 89.3 mt -73.7 -43.32 59.59 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.11 0.455 . . . . 0.0 111.223 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.517 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.53 -39.9 94.63 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -59.69 -45.05 93.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.383 -178.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.1 mtt85 -65.48 -40.01 92.61 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.745 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.441 HD22 HD11 ' A' ' 77' ' ' LEU . 0.9 OUTLIER -70.09 -43.87 70.22 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.734 0.302 . . . . 0.0 110.968 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m -139.0 117.68 12.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.804 0.335 . . . . 0.0 110.861 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.3 m -105.9 90.24 3.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.664 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.3 m -133.53 149.74 51.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.909 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.2 p90 -86.37 168.36 13.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.445 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.6 tp 73.25 -40.83 0.48 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.428 0.691 . . . . 0.0 111.768 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.42 -24.43 67.83 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.587 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.693 ' HA ' HD12 ' A' ' 63' ' ' ILE . 22.5 m -63.46 -21.87 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.904 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -64.3 -42.14 96.51 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.846 0.355 . . . . 0.0 110.576 179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -68.84 -26.36 65.11 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.023 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.693 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.9 mt -59.67 -38.99 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.183 0.516 . . . . 0.0 110.455 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.491 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.4 mm-40 -79.66 -21.24 45.01 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 122.106 -0.371 . . . . 0.0 111.193 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.17 -45.41 60.53 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.621 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.3 mt-10 -87.97 -4.72 58.78 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.491 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.8 p -58.56 -28.55 36.85 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.236 178.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -74.73 -14.75 60.76 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -95.66 9.06 41.6 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.917 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.571 ' O ' ' HB2' ' A' ' 71' ' ' LYS . . . 104.22 -7.2 47.38 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 118.33 -1.261 . . . . 0.0 114.866 179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.571 ' HB2' ' O ' ' A' ' 70' ' ' GLY . 2.0 tppt? 158.58 139.1 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-N 118.263 1.032 . . . . 0.0 112.088 177.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.654 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 3.0 t -134.27 -24.17 1.64 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.46 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.23 -67.43 2.22 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.97 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 11.3 m -88.62 -35.12 17.03 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.569 -0.371 . . . . 0.0 111.482 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.551 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 74.0 ttt180 -60.75 -46.35 90.78 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.731 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.514 ' HB3' ' O ' ' A' ' 72' ' ' SER . 80.7 tt0 -60.54 -44.27 96.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.654 0.264 . . . . 0.0 110.52 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.517 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -62.54 -47.82 82.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.253 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.906 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.3 mt -65.16 -39.81 93.45 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.53 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -81.0 -5.75 57.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 -179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.8 m -59.34 -39.84 84.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 65.8 m95 -86.27 -89.97 0.11 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.278 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.82 -87.07 0.49 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.134 0.492 . . . . 0.0 110.053 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -112.62 -56.75 2.37 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.906 ' HG3' HD22 ' A' ' 78' ' ' LEU . 13.6 ttpp -131.95 -43.57 0.98 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.11 -0.95 . . . . 0.0 108.564 176.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.6 t30 49.73 28.93 2.89 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 114.975 -1.012 . . . . 0.0 112.91 178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.611 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 37.8 mttp -135.51 134.17 39.22 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 44.5 p -83.82 161.19 21.01 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.905 -0.718 . . . . 0.0 109.61 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.06 -40.33 82.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.143 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.36 -40.21 98.66 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.49 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -63.46 -48.59 77.08 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.921 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -75.98 -24.11 55.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.862 -179.625 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.722 HD13 HD13 ' A' ' 107' ' ' ILE . 62.4 tp -58.82 -39.38 81.01 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.425 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -60.88 -41.16 95.43 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 120.868 0.366 . . . . 0.0 110.452 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -67.7 -40.71 84.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-O 121.224 0.535 . . . . 0.0 109.729 178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -60.31 -39.92 88.72 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.613 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.39 -40.02 96.09 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.812 179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -63.94 -41.67 97.55 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.731 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.0 tpt -70.05 -38.84 75.93 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.086 179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.29 29.77 11.92 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.721 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -76.22 99.47 4.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.924 0.392 . . . . 0.0 111.06 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.58 -41.83 96.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.669 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -62.31 -41.39 98.5 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.125 0.488 . . . . 0.0 110.805 -179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.506 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.89 -39.88 90.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.701 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.561 ' O ' HG22 ' A' ' 107' ' ' ILE . 42.0 mm -62.66 -45.21 99.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.12 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -66.51 -40.76 89.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.419 HD12 ' HA ' ' A' ' 106' ' ' LEU . 1.3 tp -83.89 -21.79 31.82 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.722 HD13 HD13 ' A' ' 92' ' ' LEU . 10.2 tt -65.79 -20.22 26.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.927 0.394 . . . . 0.0 111.321 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.0 p -70.05 -9.93 57.0 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.814 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -70.41 -17.62 63.02 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.611 ' HE1' HD22 ' A' ' 25' ' ' LEU . 89.7 t80 -60.29 -47.95 83.83 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.779 0.323 . . . . 0.0 110.352 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 63.64 -125.79 33.85 Favored Glycine 0 C--N 1.332 0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 113.659 179.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.03 145.78 55.88 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 121.022 0.439 . . . . 0.0 112.107 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.0 m -78.57 154.13 5.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.247 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.5 mt -109.23 133.16 53.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.855 0.359 . . . . 0.0 111.031 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 53.4 m -82.77 131.18 55.37 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.717 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -57.51 139.21 89.47 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.736 2.291 . . . . 0.0 112.549 179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 81.2 p -70.17 -30.42 67.55 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.855 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -127.82 149.0 50.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.807 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -63.97 -39.74 94.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.368 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 57.8 m -133.16 149.41 52.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.186 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.39 152.3 47.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.424 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -142.02 157.92 44.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.366 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -124.85 145.62 49.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.577 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.013 0 CA-C-O 118.505 -1.164 . . . . 0.0 112.157 -179.96 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 121.063 0.459 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -120.86 143.01 49.13 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.738 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.87 149.89 50.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.588 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.92 174.02 39.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.997 -0.62 . . . . 0.0 111.961 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.7 m -112.47 118.3 34.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.849 0.324 . . . . 0.0 110.94 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.5 mmm -119.46 11.65 12.19 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.974 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 65.14 -163.77 0.25 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.623 0.577 . . . . 0.0 111.37 -179.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 176.89 -174.71 47.26 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.139 -179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -97.63 173.18 7.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.867 0.365 . . . . 0.0 110.784 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 73.2 m -119.24 154.18 33.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.125 -179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -159.42 175.94 36.26 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.064 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.42 146.6 50.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.702 0.287 . . . . 0.0 111.09 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.6 ttp-105 -120.11 126.65 51.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.022 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -82.27 155.29 34.22 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.99 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.59 97.79 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.889 0.376 . . . . 0.0 111.373 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.8 mt -83.39 144.9 29.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.816 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.0 p -80.9 108.33 14.47 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.723 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.87 -10.02 38.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.384 178.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -106.4 21.51 17.29 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.271 -0.877 . . . . 0.0 112.073 -178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.9 t -81.64 113.58 19.75 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.078 0.77 . . . . 0.0 113.078 -178.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 24.7 mt -153.36 167.09 30.57 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.836 178.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.13 -50.19 71.42 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -81.8 -35.58 29.36 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.493 0.663 . . . . 0.0 111.348 -179.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.42 71.85 0.76 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.009 179.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -44.53 155.45 0.37 Allowed Pre-proline 0 CA--C 1.538 0.515 0 O-C-N 123.978 0.798 . . . . 0.0 111.22 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -38.69 165.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 124.846 3.697 . . . . 0.0 114.794 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -49.05 -8.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 124.01 3.14 . . . . 0.0 114.99 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.778 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.76 -35.79 64.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 117.741 0.246 . . . . 0.0 110.657 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.38 -78.64 0.59 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.4 tp -61.39 -48.65 80.25 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.264 0.839 . . . . 0.0 113.264 -177.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -51.1 60.73 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 120.595 -0.812 . . . . 0.0 114.494 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -70.79 -43.0 69.59 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.1 mt -66.9 -38.68 86.73 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.842 -178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.661 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -73.25 -30.52 63.51 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 120.397 -0.521 . . . . 0.0 111.656 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.81 -55.45 3.96 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -63.72 -45.64 96.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.29 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -178.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.883 HD11 HD12 ' A' ' 49' ' ' LEU . 88.7 mt -71.62 -21.01 61.9 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.12 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.661 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.8 t0 -61.55 -38.65 88.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.039 0.447 . . . . 0.0 110.503 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 89.4 p -85.2 1.54 47.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.107 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.6 t -64.22 141.33 58.81 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.297 0.57 . . . . 0.0 111.663 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.91 39.04 3.85 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.926 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.18 -16.73 57.89 Favored Glycine 0 CA--C 1.52 0.398 0 CA-C-N 115.573 -0.74 . . . . 0.0 113.06 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -43.06 99.34 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.971 0.415 . . . . 0.0 111.816 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 81.8 mt -108.89 -21.56 12.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.183 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.435 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.11 107.05 0.12 Allowed Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.34 -0.845 . . . . 0.0 112.563 -179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.2 p90 -52.88 -50.81 63.12 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 117.313 0.557 . . . . 0.0 110.349 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.542 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.77 -0.04 52.37 Favored 'General case' 0 C--O 1.217 -0.617 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.095 177.484 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.33 -42.42 95.57 Favored Glycine 0 C--O 1.23 -0.115 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.023 -177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 37' ' ' LEU . 94.0 mt -81.79 -42.4 19.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.735 0.303 . . . . 0.0 111.215 179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.482 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.45 -41.73 96.37 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -61.48 -41.26 96.98 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.115 -178.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -64.22 -40.0 95.15 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.76 0.314 . . . . 0.0 111.203 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.506 HD22 HD21 ' A' ' 77' ' ' LEU . 1.7 tt -70.07 -46.96 63.84 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.842 -179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 68.8 m -148.8 150.38 32.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.838 0.351 . . . . 0.0 111.511 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.492 ' OG ' ' HA3' ' A' ' 124' ' ' GLY . 80.0 p -136.75 141.49 43.0 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.53 179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.9 m -151.13 161.79 42.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.172 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -74.1 134.64 42.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.615 0.245 . . . . 0.0 110.729 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.8 mp 63.15 14.83 8.03 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 115.776 -0.647 . . . . 0.0 112.08 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -64.57 -40.03 94.81 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.886 0.374 . . . . 0.0 111.523 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.737 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.1 m -64.93 -19.98 26.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -60.97 -46.95 88.66 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.637 0.256 . . . . 0.0 110.404 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 11.0 t60 -72.66 -29.5 63.49 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.216 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.737 HD12 ' HA ' ' A' ' 60' ' ' VAL . 84.7 mt -60.23 -43.11 92.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 178.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.537 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.1 mm-40 -67.64 -35.93 79.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.238 178.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.2 -48.61 79.24 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.731 1.382 . . . . 0.0 114.731 -177.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.7 mt-10 -89.95 -3.47 58.01 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -178.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -55.85 -34.04 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 CA-C-N 118.202 0.455 . . . . 0.0 111.432 -179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -89.22 -4.77 58.09 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.935 0.397 . . . . 0.0 110.853 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.48 21.81 16.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.818 -178.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.13 21.22 9.65 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.311 -0.947 . . . . 0.0 114.22 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.7 OUTLIER 94.18 141.77 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.281 1.032 . . . . 0.0 112.248 177.418 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.565 ' H ' ' HD3' ' A' ' 71' ' ' LYS . 4.1 t -129.99 -30.38 2.01 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 114.774 -1.103 . . . . 0.0 109.998 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.35 -66.07 3.05 Favored Glycine 0 C--O 1.227 -0.286 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.022 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.456 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.02 -35.6 18.69 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.494 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.7 ttt180 -62.69 -47.22 84.6 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.552 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -62.34 -41.33 98.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.615 0.245 . . . . 0.0 111.152 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.506 HD21 HD22 ' A' ' 53' ' ' LEU . 65.9 tp -61.07 -47.22 87.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.979 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.46 HD22 ' HG3' ' A' ' 84' ' ' LYS . 84.2 mt -71.46 -39.4 70.98 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.069 0.462 . . . . 0.0 111.673 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -76.62 -7.26 54.9 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.5 p -58.43 -38.59 77.75 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 72.8 m95 -87.58 -90.57 0.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.676 -0.409 . . . . 0.0 110.928 179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.44 -86.81 0.51 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.1 mp0 -110.96 -56.89 2.31 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.62 -43.49 0.91 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.419 176.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.4 36.21 6.84 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.718 0.807 . . . . 0.0 111.788 179.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.471 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.99 171.05 14.88 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.485 -179.264 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.481 HG22 ' HG2' ' A' ' 116' ' ' PRO . 67.8 p -121.21 157.4 30.34 Favored 'General case' 0 C--N 1.321 -0.644 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.324 179.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.449 HG13 HD13 ' A' ' 29' ' ' LEU . 1.2 mp -60.5 -39.66 81.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.374 -179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.97 -39.45 98.08 Favored Glycine 0 CA--C 1.521 0.44 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.862 179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -63.23 -45.67 90.53 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.604 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.49 -24.6 50.1 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.658 -179.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.509 HD13 HD13 ' A' ' 107' ' ' ILE . 61.8 tp -58.97 -41.74 88.24 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.682 -0.236 . . . . 0.0 111.176 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.94 -41.81 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.087 0.47 . . . . 0.0 110.471 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.475 HG21 HD12 ' A' ' 53' ' ' LEU . 74.0 t -68.3 -42.06 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.431 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.0 mp -60.28 -40.17 89.47 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.004 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.1 -39.21 93.55 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.495 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -62.61 -45.33 93.34 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.476 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 14.5 tpt -72.61 -39.41 67.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.937 0.398 . . . . 0.0 111.257 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 99.37 39.55 3.44 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.472 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.407 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 13.3 t-160 -80.47 95.23 6.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 121.177 0.513 . . . . 0.0 110.546 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -64.89 -42.3 94.9 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -62.77 -39.38 94.0 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.855 0.36 . . . . 0.0 111.695 -178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.407 ' HB2' ' ND1' ' A' ' 100' ' ' HIS . . . -60.54 -38.7 85.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.279 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.457 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -60.93 -43.27 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.035 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -62.96 -42.08 99.72 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.43 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.03 -31.13 25.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.44 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.778 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.0 tt -62.3 -24.49 35.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.371 0 CA-C-O 121.18 0.514 . . . . 0.0 110.47 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 85.1 m -64.88 -26.13 68.19 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.076 178.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -67.92 -20.44 65.09 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.574 ' HE1' HD22 ' A' ' 25' ' ' LEU . 81.0 t80 -60.02 -48.93 79.67 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 178.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 58.23 -131.4 52.03 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 116.105 -0.498 . . . . 0.0 113.395 179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . 65.89 164.39 0.17 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.444 0.698 . . . . 0.0 112.448 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 17.3 m -116.74 -10.19 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.914 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 63.5 tp -131.87 130.71 42.01 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.181 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 77.6 p -129.42 151.3 77.67 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.865 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.481 ' HG2' HG22 ' A' ' 87' ' ' THR . 57.3 Cg_endo -70.81 158.61 55.11 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.638 2.225 . . . . 0.0 112.499 179.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 63.0 m -109.36 146.27 34.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.885 0.374 . . . . 0.0 110.929 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -126.28 162.01 26.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.61 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -68.89 149.17 49.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.152 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 87.5 p -70.89 160.58 32.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.485 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -146.48 162.02 39.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.389 -179.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -105.06 126.67 52.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.547 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -79.21 147.84 32.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . 0.492 ' HA3' ' OG ' ' A' ' 55' ' ' SER . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.473 -1.182 . . . . 0.0 112.512 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 121.09 0.471 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -122.4 141.43 51.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.538 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -127.89 149.32 50.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.634 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.12 172.23 39.88 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.998 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 97.8 p -153.16 161.89 41.93 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.544 0.172 . . . . 0.0 110.699 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 95.6 mmm 61.34 -131.08 0.72 Allowed 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.738 0.649 . . . . 0.0 110.803 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.407 ' HB1' HG21 ' A' ' 67' ' ' VAL . . . 56.22 61.46 2.72 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 123.289 0.368 . . . . 0.0 111.552 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -168.98 -175.47 38.37 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.427 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -145.1 174.83 10.71 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.8 m -99.03 130.95 45.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.913 0.387 . . . . 0.0 111.581 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -101.11 -174.62 28.96 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.138 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.89 149.24 31.89 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.799 0.299 . . . . 0.0 111.41 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.8 -161.57 0.85 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.824 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.16 7.89 65.19 Favored Glycine 0 C--N 1.334 0.43 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.221 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.66 -165.98 1.23 Allowed 'General case' 0 C--N 1.328 -0.338 0 O-C-N 122.782 -0.246 . . . . 0.0 110.979 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.0 mt -67.8 152.47 45.52 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.05 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -66.65 107.35 2.09 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 121.214 0.53 . . . . 0.0 111.433 -178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.52 -8.25 45.01 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.286 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -102.63 20.57 16.94 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.264 -178.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.1 m -72.61 115.08 11.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.794 0.33 . . . . 0.0 111.886 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.496 ' HB3' ' HB3' ' A' ' 24' ' ' ASP . 23.8 tp -152.85 163.24 40.12 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.0 tp -60.94 -47.63 85.54 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -90.87 -35.83 14.54 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.425 0.631 . . . . 0.0 110.555 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 83' ' ' GLN . 49.2 t0 -94.03 74.91 4.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.737 178.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.431 HD13 ' CE1' ' A' ' 110' ' ' TYR . 82.5 mt -47.37 154.21 0.86 Allowed Pre-proline 0 CA--C 1.542 0.65 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.357 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -38.61 166.41 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 124.82 3.68 . . . . 0.0 114.894 -178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_exo -46.78 -9.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 124.312 3.341 . . . . 0.0 115.545 -178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.04 -34.82 63.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 118.087 0.403 . . . . 0.0 109.987 179.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.876 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.6 tp -107.79 -77.88 0.59 Allowed 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.437 HD23 ' HA ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -61.7 -52.03 65.95 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -178.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.44 -50.57 66.32 Favored Glycine 0 CA--C 1.522 0.474 0 C-N-CA 120.343 -0.932 . . . . 0.0 114.82 -177.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 43.2 tp10 -68.84 -43.74 74.87 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 -179.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 95' ' ' LEU . 97.1 mt -68.23 -39.19 82.4 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 120.69 -0.404 . . . . 0.0 112.054 -179.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.0 p -71.6 -27.99 63.5 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 120.462 -0.495 . . . . 0.0 111.357 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.72 -57.54 3.01 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 55.6 t -64.36 -45.26 96.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.63 HD11 HD12 ' A' ' 49' ' ' LEU . 97.6 mt -70.69 -22.49 62.46 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.68 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 43.6 t0 -61.11 -36.5 79.88 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.981 0.42 . . . . 0.0 110.872 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.3 m -88.06 11.45 16.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.119 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 46.2 t -62.16 143.24 57.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.564 0.697 . . . . 0.0 112.297 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -131.9 36.97 3.65 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.393 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.64 -13.96 66.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.256 -0.884 . . . . 0.0 112.925 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.84 96.29 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.7 mt -110.56 -25.5 9.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.11 0.481 . . . . 0.0 110.561 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.457 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 77.22 109.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.184 -179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.1 p90 -52.7 -49.85 64.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.377 0.588 . . . . 0.0 110.625 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.437 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.5 ptt180 -83.91 -0.38 51.15 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.485 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.43 -45.96 93.7 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.704 -177.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.63 HD12 HD11 ' A' ' 37' ' ' LEU . 90.6 mt -74.86 -44.14 50.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.213 0.53 . . . . 0.0 111.17 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.68 -39.91 94.5 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 55.0 tp10 -59.23 -44.45 92.31 Favored 'General case' 0 C--N 1.33 -0.28 0 O-C-N 123.522 0.514 . . . . 0.0 111.371 -177.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 mtt85 -65.5 -41.01 93.68 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.708 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.815 HD23 HD21 ' A' ' 77' ' ' LEU . 52.5 tp -70.47 -44.6 67.39 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.936 -0.305 . . . . 0.0 111.531 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.3 m -144.11 139.65 28.99 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.689 0.28 . . . . 0.0 111.212 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 55.0 m -123.85 126.53 46.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.734 0.302 . . . . 0.0 110.928 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -159.26 139.41 12.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.51 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -66.79 -39.48 87.8 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.845 0.355 . . . . 0.0 111.32 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 89.3 mt -66.95 -39.06 87.17 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.943 0.402 . . . . 0.0 110.851 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.469 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.4 t70 -63.23 -44.18 95.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.767 -178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.805 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.1 m -64.47 -30.35 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -63.31 -41.12 98.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.922 0.391 . . . . 0.0 110.652 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.452 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 9.3 t60 -77.17 -22.33 52.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.174 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.805 HD12 ' HA ' ' A' ' 60' ' ' VAL . 78.9 mt -60.2 -42.62 90.94 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-O 120.9 0.381 . . . . 0.0 110.835 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.516 ' O ' HG22 ' A' ' 67' ' ' VAL . 80.3 mm-40 -71.48 -20.99 62.0 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.531 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.452 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -72.11 -46.66 55.8 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 114.801 1.408 . . . . 0.0 114.801 -177.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 67.3 mm-40 -89.78 -2.98 58.37 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -177.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.599 HG13 ' O ' ' A' ' 63' ' ' ILE . 16.2 m -55.43 -32.22 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 118.95 0.795 . . . . 0.0 111.942 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -88.44 -5.63 58.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.847 0.356 . . . . 0.0 110.471 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -107.97 18.21 21.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.897 -178.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.51 23.5 7.92 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.113 -1.042 . . . . 0.0 114.934 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.608 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 95.3 143.44 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.249 1.02 . . . . 0.0 112.559 176.855 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.612 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.1 t -132.64 -32.13 1.31 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.845 -1.071 . . . . 0.0 110.301 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -51.31 -67.39 1.99 Allowed Glycine 0 C--O 1.227 -0.319 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.697 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.2 m -86.89 -36.35 18.46 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.652 0.263 . . . . 0.0 111.283 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -60.98 -47.98 83.94 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.4 tt0 -61.42 -43.18 99.32 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 120.575 0.226 . . . . 0.0 111.26 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.815 HD21 HD23 ' A' ' 53' ' ' LEU . 59.1 tp -62.31 -45.46 93.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.115 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.527 HD22 ' HG3' ' A' ' 84' ' ' LYS . 94.5 mt -69.4 -38.72 78.09 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 120.853 0.359 . . . . 0.0 111.356 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 22.5 m95 -77.31 -5.87 51.12 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.7 m -59.1 -39.67 82.95 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -86.12 -89.95 0.11 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.987 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.39 -87.52 0.48 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.569 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 97.7 mm-40 -111.8 -53.95 2.66 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 176.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.876 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.5 ttpp -133.14 -43.88 0.86 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.938 176.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.8 t30 48.59 37.99 10.35 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.137 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.25 171.96 13.52 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.9 p -120.69 156.14 32.39 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.393 -0.523 . . . . 0.0 110.428 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -60.54 -38.62 78.74 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.106 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.58 -39.76 98.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.751 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.3 -45.73 90.03 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.623 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -77.18 -24.72 51.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.382 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.469 ' HA ' HD12 ' A' ' 95' ' ' LEU . 60.7 tp -59.83 -41.65 91.79 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.851 0.358 . . . . 0.0 110.85 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -62.55 -40.42 96.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.093 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.541 HG12 HD22 ' A' ' 49' ' ' LEU . 85.8 t -68.1 -40.07 82.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.11 178.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.528 HD21 HD21 ' A' ' 33' ' ' LEU . 91.5 mt -61.09 -39.22 89.11 Favored 'General case' 0 N--CA 1.462 0.125 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.451 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -62.77 -39.33 93.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.568 178.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -62.37 -39.87 94.6 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.698 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.47 -12.12 41.03 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.75 39.88 59.26 Favored Glycine 0 C--N 1.329 0.157 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.725 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -70.75 93.43 0.95 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.113 0.483 . . . . 0.0 110.608 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.64 ' O ' HG22 ' A' ' 104' ' ' ILE . 82.9 mtt85 -64.5 -42.25 95.94 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -66.59 -39.43 88.42 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.78 -39.07 87.49 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 101' ' ' ARG . 8.5 tp -62.83 -31.87 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.44 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -70.57 -41.2 72.72 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-O 120.71 0.29 . . . . 0.0 111.228 179.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.29 -22.19 30.79 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 -179.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.558 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.8 tp -62.03 -20.49 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 120.93 0.395 . . . . 0.0 111.231 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 81.4 p -70.39 -12.54 61.65 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.663 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -69.87 -26.8 64.36 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.76 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.53 ' CE1' ' HB3' ' A' ' 112' ' ' ALA . 78.1 t80 -63.78 126.87 28.99 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.244 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -137.79 16.51 3.51 Favored Glycine 0 C--N 1.333 0.376 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.833 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.53 ' HB3' ' CE1' ' A' ' 110' ' ' TYR . . . -81.36 162.26 23.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.904 0.383 . . . . 0.0 111.172 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 26.9 m -119.83 164.14 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.214 -179.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 93.1 mt -70.16 150.52 46.42 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.026 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.7 m 55.71 62.7 6.94 Favored Pre-proline 0 N--CA 1.468 0.465 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.84 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -56.66 -37.16 98.3 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 123.178 2.585 . . . . 0.0 113.11 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.6 m -126.5 148.3 49.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.613 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -123.81 146.2 48.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.422 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -88.11 61.73 6.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.065 0.459 . . . . 0.0 110.539 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 80.2 p -96.77 -2.71 43.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -98.62 25.26 6.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.869 0.366 . . . . 0.0 111.578 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -63.3 -39.67 95.23 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.347 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -125.59 145.02 50.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.525 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.485 -1.175 . . . . 0.0 112.187 179.997 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 120.97 0.414 . . . . 0.0 110.855 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -126.71 148.4 49.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.634 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 89.7 t80 -109.38 122.96 48.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.377 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.73 -168.9 41.91 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.818 -0.705 . . . . 0.0 112.037 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.8 m 58.76 44.05 17.66 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 122.753 0.421 . . . . 0.0 111.75 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtm -75.4 143.89 42.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.895 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -146.82 157.69 43.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.7 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -71.66 154.08 50.96 Favored Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.628 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -154.72 167.86 28.76 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.51 -46.62 89.2 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.382 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 84.0 -172.34 49.54 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.539 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -127.84 138.93 52.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.667 0.27 . . . . 0.0 110.844 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.6 mtm-85 -131.51 147.87 52.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 155.22 -145.58 12.74 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 121.037 -0.602 . . . . 0.0 111.65 -179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.86 -39.49 92.07 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.906 0.384 . . . . 0.0 110.932 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 16' ' ' LEU . 2.6 mm? -95.39 132.9 39.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.982 179.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 9.5 p -85.77 110.38 19.3 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.827 0.346 . . . . 0.0 111.468 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.03 -10.7 41.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.397 0.618 . . . . 0.0 110.552 178.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -107.28 21.46 17.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.373 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.2 t -78.77 130.87 36.23 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -169.39 -176.84 2.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.012 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mp -79.88 -57.62 3.56 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -72.92 -35.35 67.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.584 0.707 . . . . 0.0 110.7 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.27 71.1 0.73 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.165 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.532 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.4 mt -49.34 157.1 0.94 Allowed Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.077 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -37.28 163.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.086 0 C-N-CA 124.478 3.452 . . . . 0.0 115.009 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -49.52 -9.09 0.12 Allowed 'Trans proline' 0 C--N 1.361 1.235 0 C-N-CA 124.146 3.23 . . . . 0.0 114.95 -179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.682 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.19 -36.38 65.83 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 121.98 0.112 . . . . 0.0 110.995 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.934 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.4 tp -108.02 -78.12 0.59 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.87 -47.6 84.25 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -178.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.79 -52.92 49.39 Favored Glycine 0 CA--C 1.523 0.542 0 C-N-CA 120.333 -0.937 . . . . 0.0 114.73 -177.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.688 ' HB2' HD23 ' A' ' 106' ' ' LEU . 15.1 tm-20 -71.94 -43.88 64.5 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.145 0.795 . . . . 0.0 113.145 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.7 mt -66.89 -39.44 87.46 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.3 p -73.97 -30.83 62.71 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 120.121 -0.632 . . . . 0.0 111.838 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.4 -56.32 3.58 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 113.384 0.883 . . . . 0.0 113.384 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 70.2 t -64.64 -45.22 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 N-CA-C 113.051 0.759 . . . . 0.0 113.051 -177.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.428 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 83.9 mt -74.51 -17.34 60.77 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 122.165 -0.334 . . . . 0.0 111.42 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 7.3 t70 -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.028 0.442 . . . . 0.0 110.976 178.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 59.1 m -88.85 10.79 19.88 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.53 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 21.0 t -67.49 145.2 55.2 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.087 0.47 . . . . 0.0 111.199 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -135.95 50.75 2.07 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.72 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.96 -12.73 69.32 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.01 -0.614 . . . . 0.0 113.9 179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.58 98.79 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 117.285 0.542 . . . . 0.0 110.992 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 79.7 mt -120.52 -30.49 4.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.329 178.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 86.31 118.08 1.04 Allowed Glycine 0 N--CA 1.443 -0.846 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.544 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.404 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 6.4 p90 -56.0 -43.03 77.27 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.057 0.428 . . . . 0.0 110.348 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.47 ' HB3' HG21 ' A' ' 63' ' ' ILE . 40.0 ptt180 -83.66 0.44 46.93 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.419 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.3 -50.2 63.77 Favored Glycine 0 CA--C 1.516 0.148 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.914 -177.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 93.1 mt -71.99 -42.0 66.99 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.288 0.544 . . . . 0.0 111.496 179.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.58 -42.71 91.45 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.33 -45.76 92.31 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.286 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.407 ' NH2' ' HG2' ' A' ' 97' ' ' GLU . 99.7 mtt180 -70.22 -36.64 74.68 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.716 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.665 HD22 HD21 ' A' ' 77' ' ' LEU . 3.3 tt -66.85 -44.43 81.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.767 -0.197 . . . . 0.0 111.214 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.3 p -158.38 158.69 34.72 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.95 0.405 . . . . 0.0 111.533 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 65.7 m -135.35 145.33 47.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.748 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.576 ' OG ' ' HB2' ' A' ' 59' ' ' ASP . 98.5 p -156.82 163.56 39.07 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.607 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 21.3 t90 -70.78 129.83 40.13 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.473 -179.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 85.6 mt 63.65 18.22 10.96 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.642 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.576 ' HB2' ' OG ' ' A' ' 56' ' ' SER . 37.4 t70 -64.05 -41.02 97.53 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.886 0.374 . . . . 0.0 111.513 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.748 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.8 m -67.7 -20.07 25.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -178.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -60.75 -47.92 84.15 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.762 0.315 . . . . 0.0 110.774 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.46 -28.15 61.8 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.559 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 60' ' ' VAL . 84.8 mt -60.1 -44.05 94.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-O 121.331 0.586 . . . . 0.0 110.03 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.534 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -66.78 -37.09 83.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.249 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.96 -46.71 86.44 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -177.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.0 mt-10 -89.78 -4.28 57.73 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.534 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.4 p -56.87 -33.31 41.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 118.361 0.528 . . . . 0.0 111.141 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.87 -4.36 58.49 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.931 0.396 . . . . 0.0 110.842 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.0 mm-40 -106.58 21.61 17.18 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.84 -178.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.641 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.94 21.56 9.5 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.233 -0.984 . . . . 0.0 114.282 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.641 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.1 OUTLIER 95.24 147.47 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.602 1.161 . . . . 0.0 111.667 177.687 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.3 t -134.8 -36.57 0.84 Allowed 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 115.067 -0.97 . . . . 0.0 110.401 178.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.22 -66.0 2.61 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.312 -0.947 . . . . 0.0 112.486 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 20.6 m -86.18 -37.51 18.63 Favored 'General case' 0 C--N 1.32 -0.687 0 O-C-N 122.352 -0.499 . . . . 0.0 111.273 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -60.95 -47.17 87.65 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.1 tt0 -62.32 -42.17 99.15 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.626 0.25 . . . . 0.0 110.817 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.665 HD21 HD22 ' A' ' 53' ' ' LEU . 63.2 tp -61.32 -46.24 91.09 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.002 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.578 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.5 mt -70.06 -39.13 75.86 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.432 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 58.8 m95 -79.57 -4.88 53.52 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -179.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.2 m -58.37 -39.77 80.47 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -86.37 -90.01 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.959 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.96 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.3 0.571 . . . . 0.0 109.724 178.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 14.0 mp0 -111.88 -57.11 2.31 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.934 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.0 ttpp -132.24 -43.45 0.95 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.184 176.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.8 t30 48.24 34.72 4.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.816 0.847 . . . . 0.0 111.647 178.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.36 170.89 15.11 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.381 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 62.6 p -122.57 158.72 29.29 Favored 'General case' 0 C--N 1.32 -0.674 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.336 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.647 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.39 -40.82 82.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.144 -179.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.28 -39.86 98.26 Favored Glycine 0 CA--C 1.525 0.671 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.719 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -63.67 -45.86 88.19 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.558 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.78 -24.5 52.89 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.365 -179.749 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.5 tp -60.03 -40.8 90.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.409 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -61.41 -43.21 99.26 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.937 0.399 . . . . 0.0 110.791 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.464 HG21 HD12 ' A' ' 53' ' ' LEU . 81.4 t -70.3 -40.05 77.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-O 121.618 0.723 . . . . 0.0 109.65 178.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 100' ' ' HIS . 50.1 tp -60.85 -40.47 93.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.649 -1.16 . . . . 0.0 111.26 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -61.66 -38.88 89.37 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.407 ' HG2' ' NH2' ' A' ' 52' ' ' ARG . 86.3 tt0 -62.66 -42.4 99.59 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 52.2 tpp -70.61 -40.0 73.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.379 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 81.75 40.09 11.2 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.713 -0.756 . . . . 0.0 113.578 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.662 ' HB3' HD11 ' A' ' 95' ' ' LEU . 20.7 t-160 -75.84 111.79 11.56 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.373 0.606 . . . . 0.0 110.73 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -65.32 -43.04 92.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.552 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.4 tpp180 -69.74 -38.72 76.94 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.11 -42.04 93.86 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -178.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.501 ' O ' HG22 ' A' ' 107' ' ' ILE . 46.8 pt -70.66 -27.41 30.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.868 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -63.82 -49.91 70.99 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.214 178.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.688 HD23 ' HB2' ' A' ' 32' ' ' GLU . 12.3 tp -83.92 -22.92 31.39 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.682 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.2 tt -61.84 -21.75 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-O 121.107 0.48 . . . . 0.0 111.148 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 54.3 m -62.17 -25.32 67.7 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.399 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -70.33 -14.15 62.46 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.532 ' HE1' HD22 ' A' ' 25' ' ' LEU . 72.0 t80 -69.97 127.76 34.0 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.755 0.312 . . . . 0.0 110.587 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -151.74 41.38 0.74 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.659 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -104.26 131.42 51.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.896 0.379 . . . . 0.0 110.982 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 19.1 m -108.47 3.47 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.56 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 64.6 tp -108.75 121.6 45.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.94 0.4 . . . . 0.0 110.777 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.8 m -131.5 149.41 73.47 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.106 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.25 145.15 53.5 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.331 2.021 . . . . 0.0 112.603 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 79.9 p -96.74 -6.56 36.02 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.329 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -138.06 135.51 35.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.272 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -72.87 136.46 45.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.686 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.8 m -134.66 153.28 52.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.371 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -109.5 128.8 55.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.698 0.285 . . . . 0.0 110.277 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.413 ' HG3' ' HG2' ' A' ' 123' ' ' GLU . 70.1 tp60 -130.04 127.77 40.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.114 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.413 ' HG2' ' HG3' ' A' ' 122' ' ' GLN . 11.5 mm-40 57.06 39.31 29.29 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 123.516 0.51 . . . . 0.0 111.593 -179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.132 -1.371 . . . . 0.0 112.215 179.978 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 120.84 0.353 . . . . 0.0 110.812 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -64.47 -38.99 92.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.355 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -125.71 148.39 49.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.49 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -152.1 163.96 30.32 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.642 -0.789 . . . . 0.0 112.127 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 91.9 p -73.46 160.34 31.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.909 0.385 . . . . 0.0 111.378 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.1 mtp -126.12 147.29 49.64 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.363 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -148.01 156.55 42.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.902 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -167.53 174.76 42.63 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.0 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -108.19 137.95 45.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.778 0.323 . . . . 0.0 110.681 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 52.8 t -124.22 126.96 46.98 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.494 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -145.82 156.27 26.89 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.139 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -152.23 158.33 42.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.496 0.148 . . . . 0.0 110.868 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 64.53 -157.65 0.3 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 123.664 0.603 . . . . 0.0 111.603 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.0 -179.37 42.58 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.387 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.3 -89.33 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.18 0.592 . . . . 0.0 111.698 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.7 tp -108.16 125.45 51.64 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -75.19 109.92 9.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.106 0.479 . . . . 0.0 111.275 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 -7.75 52.59 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.928 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -103.9 21.47 16.27 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.295 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -70.67 119.72 15.24 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.36 161.67 12.1 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.071 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.8 tp -65.03 -50.5 66.0 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -81.24 -35.65 30.95 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.43 0.633 . . . . 0.0 111.341 -179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -112.52 70.77 0.72 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.627 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.514 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.3 mt -46.11 156.28 0.48 Allowed Pre-proline 0 CA--C 1.537 0.464 0 O-C-N 123.904 0.753 . . . . 0.0 111.372 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -38.43 165.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 124.91 3.74 . . . . 0.0 114.725 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -49.33 -9.35 0.12 Allowed 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 124.041 3.16 . . . . 0.0 114.996 -178.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.69 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.48 -35.9 63.57 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.374 0.13 . . . . 0.0 110.734 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.895 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.74 -78.8 0.59 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 61.6 tp -61.42 -48.02 83.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.76 -51.52 58.14 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.654 -0.784 . . . . 0.0 114.467 -177.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.634 ' HB2' HD22 ' A' ' 106' ' ' LEU . 37.4 tp10 -70.57 -43.39 69.56 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -66.63 -39.34 88.24 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -178.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -71.78 -30.34 65.45 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 120.55 -0.46 . . . . 0.0 111.712 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.23 -56.75 3.38 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 -178.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.3 t -64.26 -44.51 97.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.0 mt -72.07 -19.15 61.86 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.351 -179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.495 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 16.0 t70 -59.75 -38.91 83.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.054 0.454 . . . . 0.0 110.747 179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.9 m -88.71 6.3 39.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.989 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 46.0 t -65.69 141.48 58.35 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.256 0.55 . . . . 0.0 111.536 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -132.68 50.68 2.21 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.252 -179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.98 -11.64 71.65 Favored Glycine 0 CA--C 1.52 0.373 0 CA-C-N 115.803 -0.635 . . . . 0.0 113.49 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.49 -42.8 98.52 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 117.253 0.527 . . . . 0.0 111.066 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 89.0 mt -119.94 -23.31 6.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.909 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.47 111.69 0.2 Allowed Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.232 -0.895 . . . . 0.0 112.285 -179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.477 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 21.3 p90 -54.08 -44.4 71.14 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.235 0.518 . . . . 0.0 110.88 178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.704 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.71 -0.08 52.32 Favored 'General case' 0 C--O 1.22 -0.471 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.781 178.249 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.96 -45.38 95.23 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.446 -177.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.484 HD22 HG12 ' A' ' 94' ' ' VAL . 87.0 mt -71.55 -42.92 67.27 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.847 0.323 . . . . 0.0 111.163 179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.808 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.34 -43.26 91.48 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.41 -40.08 95.35 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.694 -178.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.04 -44.8 96.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.791 HD23 HD11 ' A' ' 77' ' ' LEU . 57.3 tp -70.3 -45.43 66.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.172 179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.0 m -148.53 138.93 22.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.665 0.269 . . . . 0.0 111.149 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.7 m -122.95 121.06 35.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.712 0.291 . . . . 0.0 111.674 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 93.4 p -159.82 158.37 30.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.994 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 30.1 m-90 -69.46 -38.99 78.01 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.788 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.3 mt -65.46 -40.28 93.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.912 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.428 ' O ' HG13 ' A' ' 63' ' ' ILE . 36.9 t70 -63.91 -46.07 86.45 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.776 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.7 m -70.87 -23.54 23.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.19 -46.48 88.75 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.982 0.42 . . . . 0.0 110.576 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 12.7 t60 -73.89 -25.97 60.29 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.287 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 60' ' ' VAL . 81.2 mt -59.4 -42.25 87.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.068 0.461 . . . . 0.0 110.875 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.474 ' O ' HG12 ' A' ' 67' ' ' VAL . 16.5 mm-40 -69.51 -27.44 65.18 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.029 179.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 99.1 mttt -70.26 -50.07 43.38 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 114.322 1.231 . . . . 0.0 114.322 -178.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.2 mt-10 -89.53 -3.56 58.28 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.7 p -55.54 -34.62 35.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 118.158 0.435 . . . . 0.0 111.308 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.17 -4.12 58.36 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.942 0.401 . . . . 0.0 110.76 178.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -105.68 21.88 16.49 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.796 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.612 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.14 22.26 8.88 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.266 -0.969 . . . . 0.0 114.363 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.612 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 94.18 140.16 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.251 1.02 . . . . 0.0 112.212 177.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.57 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.9 t -131.87 -25.82 2.03 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.483 178.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.584 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -57.01 -66.19 3.03 Favored Glycine 0 N--CA 1.446 -0.669 0 C-N-CA 120.023 -1.084 . . . . 0.0 112.11 179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.422 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 21.4 m -87.58 -36.63 17.43 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.428 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.3 ttt180 -60.37 -47.95 83.86 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.744 -177.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.57 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.3 tt0 -63.04 -40.61 98.24 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.868 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.808 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.15 -46.16 91.68 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.3 mt -68.74 -39.37 80.36 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.241 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -78.07 -5.64 52.12 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.3 m -58.92 -39.74 82.46 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 95.3 m95 -85.99 -89.7 0.11 Allowed 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.42 -86.67 0.49 Allowed 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -114.68 -54.01 2.61 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.895 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.62 -44.9 0.89 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 175.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.8 t30 47.87 32.17 2.63 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.76 0.824 . . . . 0.0 112.221 178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.509 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.38 132.57 29.78 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 57.9 p -81.95 160.45 23.35 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.067 -0.653 . . . . 0.0 110.65 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.562 HG23 HD11 ' A' ' 107' ' ' ILE . 1.2 mp -60.31 -38.94 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.122 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.99 -39.04 97.59 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.726 179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -62.32 -46.26 89.52 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.59 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -78.55 -24.38 45.67 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.564 0.209 . . . . 0.0 111.564 -179.619 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.526 HD13 HD13 ' A' ' 107' ' ' ILE . 61.4 tp -59.45 -40.53 87.16 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.627 0.251 . . . . 0.0 111.077 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -62.29 -41.3 98.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.559 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.484 HG12 HD22 ' A' ' 49' ' ' LEU . 87.5 t -69.63 -40.19 79.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.032 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 91' ' ' LEU . 3.7 mp -59.31 -36.95 76.55 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.241 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 92' ' ' LEU . 99.0 mm-40 -62.97 -39.9 96.08 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.287 179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -62.57 -46.08 89.98 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.789 0.328 . . . . 0.0 110.718 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.1 mmt -70.36 -36.59 74.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.15 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 101' ' ' ARG . . . 93.53 40.61 4.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.245 -0.979 . . . . 0.0 111.983 -179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -76.89 86.95 3.45 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 111.317 -179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.477 ' HD3' ' O ' ' A' ' 99' ' ' GLY . 1.4 mpp_? -63.18 -43.35 98.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.529 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 6.7 tpm_? -63.32 -39.9 95.85 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.688 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.472 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.87 -37.79 83.35 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.974 -179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.569 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.3 mt -60.21 -43.18 92.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.615 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -63.93 -43.21 96.59 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.634 HD22 ' HB2' ' A' ' 32' ' ' GLU . 0.3 OUTLIER -84.44 -23.05 30.13 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.106 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.69 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.7 tt -64.74 -20.96 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.845 0.355 . . . . 0.0 111.632 -179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 79.7 p -69.08 -16.7 63.74 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.448 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 99.4 m-20 -71.73 -14.65 62.08 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.576 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.514 ' HE1' HD22 ' A' ' 25' ' ' LEU . 63.8 t80 -60.25 -48.39 81.95 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.657 -0.247 . . . . 0.0 111.287 179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 76.6 71.31 1.19 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.468 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -77.38 58.77 1.73 Allowed 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 74.9 t -65.74 -43.38 93.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.159 0.504 . . . . 0.0 110.444 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -148.0 165.53 30.46 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.295 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 116' ' ' PRO . 49.1 m -80.22 123.73 83.07 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.875 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 115' ' ' SER . 76.2 Cg_exo -55.73 -35.22 92.92 Favored 'Trans proline' 0 N--CA 1.48 0.688 0 C-N-CA 123.245 2.63 . . . . 0.0 113.099 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 84.2 p -63.82 -24.48 67.77 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.691 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 56.24 40.79 29.88 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 122.996 0.518 . . . . 0.0 112.217 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -85.28 67.93 10.32 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.995 0.426 . . . . 0.0 110.971 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 90.9 p -71.25 -21.18 62.14 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.524 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -116.75 128.11 55.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.633 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 -104.94 140.57 37.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.703 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -64.08 -39.43 94.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.335 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.233 -179.971 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.997 0.427 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -122.87 142.97 50.19 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.613 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -127.91 145.36 50.98 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.45 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.22 -179.32 42.74 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.148 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.7 p -96.07 134.2 39.4 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.732 0.301 . . . . 0.0 110.705 179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 61.5 mtt -131.48 -52.62 1.01 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.102 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 54.79 56.58 6.54 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.64 0.588 . . . . 0.0 112.069 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -61.79 -40.65 99.09 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 121.053 -0.594 . . . . 0.0 113.273 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 53.87 41.13 32.15 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 75.0 m -124.93 152.04 44.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.927 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 138.27 161.72 8.93 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.532 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -151.84 152.09 32.17 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 122.038 0.135 . . . . 0.0 110.682 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.8 mtp180 -127.88 -65.89 0.89 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.798 0.332 . . . . 0.0 110.994 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.47 156.04 30.23 Favored Glycine 0 CA--C 1.519 0.327 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.692 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.93 -39.84 95.08 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.94 0.4 . . . . 0.0 111.604 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -108.48 149.31 28.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.197 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -72.41 108.71 5.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.134 0.492 . . . . 0.0 111.154 -179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.23 -7.67 50.61 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.968 179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -103.86 21.62 15.98 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.586 -179.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.8 m -75.61 117.44 17.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.074 -0.251 . . . . 0.0 111.652 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -161.9 169.21 21.63 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.735 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.7 tp -64.18 -50.52 67.79 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.418 ' HB2' ' OE1' ' A' ' 83' ' ' GLN . 99.7 m-85 -91.92 -35.68 13.88 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.277 0.56 . . . . 0.0 111.133 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.9 70.76 1.11 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.307 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.542 HD22 ' HE2' ' A' ' 110' ' ' TYR . 94.0 mt -47.43 156.32 0.64 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.642 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.55 166.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.364 1.35 0 C-N-CA 125.257 3.972 . . . . 0.0 114.977 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -48.89 -8.89 0.08 OUTLIER 'Trans proline' 0 C--N 1.361 1.232 0 C-N-CA 124.112 3.208 . . . . 0.0 115.312 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.454 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.7 -36.55 67.3 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 118.025 0.375 . . . . 0.0 110.219 179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.97 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.66 -78.37 0.59 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.9 tp -61.11 -48.72 80.35 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -177.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.07 -51.26 59.54 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 120.473 -0.87 . . . . 0.0 114.343 -177.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.467 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.39 -43.28 70.37 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.9 mt -67.22 -37.89 84.35 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.61 -0.436 . . . . 0.0 112.085 -178.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.7 p -75.28 -31.7 60.81 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.774 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.97 -56.89 3.26 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.439 HG11 ' HG2' ' A' ' 102' ' ' ARG . 61.4 t -63.49 -44.77 98.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 100' ' ' HIS . 70.5 mt -72.84 -19.42 61.31 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.187 -179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.621 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 39.6 t0 -62.02 -36.19 80.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.168 0.508 . . . . 0.0 110.158 178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.8 m -88.1 7.41 31.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.996 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 51.7 t -62.76 142.77 58.02 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.411 0.624 . . . . 0.0 111.717 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -130.35 40.0 3.58 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.849 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.15 -11.96 69.81 Favored Glycine 0 CA--C 1.519 0.3 0 CA-C-N 115.456 -0.793 . . . . 0.0 113.094 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.77 -42.88 97.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.967 0.383 . . . . 0.0 111.654 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 92.0 mt -113.8 -22.06 10.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.078 0.466 . . . . 0.0 110.5 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.9 109.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.705 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.4 p90 -52.12 -52.38 51.88 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 117.107 0.454 . . . . 0.0 110.641 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.55 0.64 45.7 Favored 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.752 178.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.74 -47.08 91.03 Favored Glycine 0 C--N 1.329 0.181 0 C-N-CA 120.137 -1.03 . . . . 0.0 113.158 -177.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 HG12 ' A' ' 94' ' ' VAL . 94.7 mt -73.38 -43.19 61.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.96 0.38 . . . . 0.0 111.376 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.709 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.72 -40.73 95.82 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 113.102 0.779 . . . . 0.0 113.102 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.2 tp10 -60.68 -43.74 97.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.243 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -64.79 -41.11 96.08 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.881 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 77' ' ' LEU . 55.8 tp -68.08 -44.2 76.82 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.943 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.1 m -141.86 127.11 18.62 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.737 0.303 . . . . 0.0 110.871 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 32.9 m -115.01 99.58 7.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.666 0.27 . . . . 0.0 110.585 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.4 m -131.67 146.62 52.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.931 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.478 ' O ' ' HB2' ' A' ' 58' ' ' LEU . 48.8 t-105 -81.15 150.89 28.51 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.539 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 57' ' ' TRP . 83.9 mt 77.32 -30.65 0.17 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.862 0.865 . . . . 0.0 112.167 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -62.88 -35.48 80.14 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.678 0.275 . . . . 0.0 111.376 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.685 ' HA ' HD12 ' A' ' 63' ' ' ILE . 19.0 m -59.84 -20.65 19.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 112.31 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -63.54 -42.4 98.41 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 120.837 0.351 . . . . 0.0 110.411 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -68.17 -29.27 68.1 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.397 179.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.685 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.9 mt -60.01 -42.8 90.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.433 0.635 . . . . 0.0 109.63 178.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.19 -35.93 76.78 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.172 178.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -62.78 -47.59 82.81 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.528 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.1 mt-10 -89.56 -3.62 58.23 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.1 p -57.13 -32.48 40.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 118.18 0.445 . . . . 0.0 111.146 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.83 -4.67 58.43 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.922 0.391 . . . . 0.0 110.693 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -106.38 21.56 17.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.728 -178.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.606 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 22.3 8.9 Favored Glycine 0 CA--C 1.521 0.437 0 C-N-CA 120.391 -0.909 . . . . 0.0 114.254 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.606 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.9 OUTLIER 93.75 142.65 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.279 1.032 . . . . 0.0 112.129 177.512 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.577 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.6 t -130.74 -31.74 1.73 Allowed 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.964 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.447 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.44 -62.99 5.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.172 -1.013 . . . . 0.0 112.299 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.515 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.14 -37.3 16.29 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.384 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.8 ttt180 -62.3 -47.41 84.41 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -178.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.56 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.7 tt0 -63.25 -40.02 96.25 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.734 0.302 . . . . 0.0 110.632 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.709 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.3 tp -61.16 -46.38 90.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.171 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.479 HD22 ' HG3' ' A' ' 84' ' ' LYS . 86.1 mt -71.17 -40.21 71.42 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.998 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -82.52 -5.94 59.03 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -59.13 -41.94 89.45 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 53.8 m95 -85.8 -89.9 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.48 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.19 -86.91 0.5 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.293 0.568 . . . . 0.0 110.596 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.418 ' OE1' ' HB2' ' A' ' 23' ' ' PHE . 91.8 mt-30 -112.46 -57.23 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.97 ' HD2' HD23 ' A' ' 29' ' ' LEU . 16.8 ttpp -131.73 -42.45 1.02 Allowed 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 175.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.2 t30 49.28 30.44 3.16 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 124.135 0.974 . . . . 0.0 111.857 178.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.5 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 9.6 mptt -139.57 164.24 30.42 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 70.0 p -124.95 160.16 29.55 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.539 179.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.8 mp -59.45 -41.85 85.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.971 -179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.81 99.4 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.914 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.74 -40.28 95.05 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.629 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -74.87 -29.42 61.01 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.7 -179.58 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.566 HD21 HG12 ' A' ' 107' ' ' ILE . 74.4 mt -59.6 -37.51 78.74 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.884 0.373 . . . . 0.0 110.343 179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -58.97 -46.49 87.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.286 178.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.472 HG12 HD22 ' A' ' 49' ' ' LEU . 92.6 t -70.51 -39.57 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.727 179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.452 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.0 mp -57.78 -39.47 77.55 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.35 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -63.8 -38.85 92.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.142 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -63.17 -40.6 98.0 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.913 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 95.7 mmm -90.4 -10.75 42.73 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 73.9 39.73 46.02 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.853 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.405 ' CD2' HD21 ' A' ' 37' ' ' LEU . 16.1 m80 -74.28 81.39 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.085 0.469 . . . . 0.0 111.579 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.6 mtt85 -63.21 -42.2 99.26 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.542 -0.753 . . . . 0.0 112.57 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.439 ' HG2' HG11 ' A' ' 36' ' ' VAL . 22.2 tpp85 -62.21 -41.55 98.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.025 0.44 . . . . 0.0 110.761 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.47 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.27 -39.17 89.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.305 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.5 mt -62.66 -42.89 97.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.631 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.16 -41.45 99.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.706 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.467 ' CB ' ' HG3' ' A' ' 32' ' ' GLU . 0.0 OUTLIER -81.36 -23.51 37.67 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.599 HG22 ' O ' ' A' ' 104' ' ' ILE . 0.9 OUTLIER -64.82 -20.3 27.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 120.859 0.362 . . . . 0.0 111.251 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 59.0 p -71.03 -7.25 45.06 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.604 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 61.0 t30 -68.62 -27.1 65.73 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.758 0.313 . . . . 0.0 110.978 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.542 ' HE2' HD22 ' A' ' 25' ' ' LEU . 0.3 OUTLIER -103.3 106.95 17.59 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 178.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -61.78 -40.17 98.45 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 116.012 -0.54 . . . . 0.0 114.135 -179.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -127.18 147.92 50.19 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.949 0.374 . . . . 0.0 110.91 -179.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 57.2 t -96.72 121.23 47.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 120.92 0.391 . . . . 0.0 110.401 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 65.8 tp -107.48 125.97 51.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.162 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.2 m -109.69 105.18 56.88 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.872 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -74.5 158.73 43.85 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.831 2.354 . . . . 0.0 112.557 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.1 m -64.06 137.89 58.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.509 179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -123.08 134.88 54.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.788 -179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt -64.74 -39.59 93.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.223 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 t 61.22 -155.22 0.36 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.228 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 54.62 -124.63 2.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 123.593 0.558 . . . . 0.0 111.233 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 56.48 -113.14 0.74 Allowed 'General case' 0 N--CA 1.467 0.397 0 O-C-N 123.422 0.452 . . . . 0.0 111.408 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.3 mt-10 -125.33 143.27 51.05 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.722 0.296 . . . . 0.0 110.522 -179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.475 -1.18 . . . . 0.0 112.262 179.999 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 121.035 0.445 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -120.03 135.76 54.81 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.473 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -103.73 5.71 36.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.482 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 74.03 -155.21 49.03 Favored Glycine 0 CA--C 1.518 0.267 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.446 -179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 51.0 m 56.46 45.55 22.36 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.966 0.412 . . . . 0.0 111.56 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.475 ' SD ' ' HG2' ' A' ' 64' ' ' GLU . 75.4 mtm -125.31 147.47 49.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.162 -179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.6 160.9 42.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.041 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -158.75 -179.91 33.94 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.413 -0.899 . . . . 0.0 112.858 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -148.46 -179.97 7.35 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 122.403 0.281 . . . . 0.0 110.473 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.6 m -114.76 148.89 37.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.817 0.341 . . . . 0.0 111.157 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -107.63 143.56 15.97 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.344 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.4 -40.24 95.86 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 68.61 -84.19 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.725 0.64 . . . . 0.0 111.234 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 99.99 155.53 28.03 Favored Glycine 0 CA--C 1.519 0.282 0 C-N-CA 120.934 -0.65 . . . . 0.0 113.039 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.06 -40.78 97.03 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.824 0.345 . . . . 0.0 111.712 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 91.3 mt -81.62 144.29 31.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.355 179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.6 p -81.63 110.15 16.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.862 0.363 . . . . 0.0 111.463 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.96 -11.13 39.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.28 0.562 . . . . 0.0 110.587 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -108.76 21.03 17.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.559 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.7 t -72.43 125.46 27.44 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.229 0.538 . . . . 0.0 112.422 -178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -167.56 -178.21 3.85 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.586 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.442 HD13 ' HA ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -80.38 -58.98 2.88 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -72.9 -35.4 67.09 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.608 0.718 . . . . 0.0 110.691 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -110.56 71.33 0.75 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.737 -1.119 . . . . 0.0 110.092 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.604 HD22 ' HE1' ' A' ' 110' ' ' TYR . 95.3 mt -48.24 156.54 0.77 Allowed Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -36.12 163.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 124.632 3.555 . . . . 0.0 115.176 -179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -50.52 -8.9 0.16 Allowed 'Trans proline' 0 C--N 1.363 1.299 0 C-N-CA 123.978 3.119 . . . . 0.0 114.634 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.688 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.17 -35.59 64.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.901 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -108.3 -79.5 0.58 Allowed 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 179.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . 62.4 tp -62.3 -47.68 83.21 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.45 -52.26 53.71 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 120.593 -0.813 . . . . 0.0 114.645 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.486 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -71.12 -43.23 68.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -179.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.8 mt -66.35 -39.73 89.37 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 14.0 p -73.13 -30.14 63.4 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.847 -179.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.53 -55.82 3.81 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 68.6 t -64.63 -45.25 95.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.678 ' HB2' ' HZ1' ' A' ' 71' ' ' LYS . 82.6 mt -74.39 -17.82 60.75 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.713 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.55 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 19.3 t70 -59.56 -38.74 81.9 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.104 0.478 . . . . 0.0 110.541 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.6 p -90.29 10.04 26.37 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.354 179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.7 t -66.5 147.24 53.56 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.18 0.514 . . . . 0.0 111.237 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -136.53 49.54 2.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.242 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 91.94 -10.3 74.77 Favored Glycine 0 CA--C 1.519 0.34 0 CA-C-N 115.759 -0.655 . . . . 0.0 113.422 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.64 99.79 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.003 0.43 . . . . 0.0 111.154 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -122.38 -32.39 3.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.17 114.92 1.4 Allowed Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.583 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.47 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 9.0 p90 -55.15 -44.17 74.86 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 117.036 0.418 . . . . 0.0 110.572 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.738 ' HB3' HD13 ' A' ' 63' ' ' ILE . 1.5 ppt_? -84.83 -0.5 54.14 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.728 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -48.69 83.41 Favored Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.299 -177.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.425 HD22 HD12 ' A' ' 95' ' ' LEU . 95.0 mt -73.28 -41.82 63.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.9 0.381 . . . . 0.0 111.214 179.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.74 -43.1 97.47 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -60.73 -44.38 96.72 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 123.368 0.417 . . . . 0.0 111.636 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -67.91 -40.59 83.39 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.468 HD23 HD21 ' A' ' 77' ' ' LEU . 56.6 tp -70.09 -45.47 66.91 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.6 m -144.52 150.83 38.21 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.892 0.377 . . . . 0.0 111.245 -179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 89.6 p -142.72 152.71 42.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.699 0.285 . . . . 0.0 110.961 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.8 t -162.72 178.75 8.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.611 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 51.6 m0 -82.81 129.45 34.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.495 0.188 . . . . 0.0 110.805 -179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 88.9 mt 57.7 30.06 18.3 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.099 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 52.1 p-10 -72.11 -20.44 61.64 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.817 ' HA ' HD12 ' A' ' 63' ' ' ILE . 32.4 m -75.82 -17.16 15.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -60.85 -47.65 85.4 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.246 -178.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.524 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 11.3 p-80 -78.69 -19.11 53.24 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.823 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.817 HD12 ' HA ' ' A' ' 60' ' ' VAL . 77.8 mt -61.96 -41.18 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 121.303 0.573 . . . . 0.0 110.457 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.531 ' O ' HG12 ' A' ' 67' ' ' VAL . 96.3 mt-10 -69.55 -34.0 73.57 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.923 0.392 . . . . 0.0 110.995 178.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.41 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.2 mttt -62.4 -47.98 81.74 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.612 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 58.4 mm-40 -89.5 -4.31 57.98 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.7 p -57.11 -30.82 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.462 0 CA-C-N 118.233 0.47 . . . . 0.0 110.894 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -88.33 -5.22 58.45 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.12 0.486 . . . . 0.0 110.596 178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -109.36 22.91 15.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.766 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.682 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.61 11.55 30.59 Favored Glycine 0 CA--C 1.521 0.419 0 CA-C-O 118.858 -0.968 . . . . 0.0 114.633 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.682 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 105.73 147.76 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 125.112 1.365 . . . . 0.0 111.744 177.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.614 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.6 t -132.34 -26.06 1.9 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.762 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.92 -66.56 2.71 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 119.036 -1.554 . . . . 0.0 111.007 178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 24.2 m -87.03 -40.02 15.1 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 71' ' ' LYS . 76.0 ttt-85 -61.55 -47.91 83.41 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.614 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.9 tp10 -61.75 -43.05 99.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.515 0.198 . . . . 0.0 110.859 -178.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.468 HD21 HD23 ' A' ' 53' ' ' LEU . 60.1 tp -63.59 -45.74 89.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.588 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.594 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.1 mt -67.16 -39.11 86.45 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 120.888 0.375 . . . . 0.0 111.178 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -78.2 -6.27 54.34 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 65.2 m -59.18 -39.74 83.49 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -85.9 -90.14 0.11 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.198 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.98 -86.49 0.5 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.168 0.509 . . . . 0.0 109.679 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -111.16 -57.61 2.22 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.901 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.2 ttpp -133.13 -42.76 0.88 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.187 -0.915 . . . . 0.0 108.71 175.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 46.0 t30 49.4 32.84 4.89 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 115.15 -0.932 . . . . 0.0 112.153 178.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.536 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.59 130.4 26.07 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.72 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 51.5 p -81.55 160.2 23.94 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.991 -0.683 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.5 -38.4 77.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.041 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.4 -39.32 97.62 Favored Glycine 0 CA--C 1.521 0.467 0 C-N-CA 121.058 -0.592 . . . . 0.0 112.915 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.98 -45.19 93.58 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.655 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -78.01 -23.94 48.1 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.681 -0.236 . . . . 0.0 111.397 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.437 HD13 HD13 ' A' ' 107' ' ' ILE . 62.2 tp -58.98 -40.92 86.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.087 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -61.92 -41.48 97.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 110.265 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 76.5 t -67.98 -41.55 84.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.154 178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.5 mp -60.15 -39.21 85.54 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.119 179.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -62.94 -40.63 98.23 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.5 tp10 -65.19 -42.89 93.17 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.566 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.8 tpt -68.43 -38.56 81.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.196 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.69 26.15 39.51 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.612 -0.804 . . . . 0.0 113.464 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.413 ' NE2' ' HB3' ' A' ' 102' ' ' ARG . 20.7 t-160 -77.48 106.16 9.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 117.098 0.449 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -63.96 -42.23 97.33 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.413 ' HB3' ' NE2' ' A' ' 100' ' ' HIS . 25.2 tpp180 -62.57 -42.25 99.43 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.865 0.364 . . . . 0.0 110.96 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.437 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.63 -42.04 98.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.497 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.653 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.2 mt -64.24 -43.28 97.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.38 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.5 t60 -61.0 -47.96 84.03 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.443 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.489 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -76.99 -24.94 52.22 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.688 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.9 tt -64.7 -20.68 27.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 CA-C-O 120.816 0.341 . . . . 0.0 111.723 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 72.2 p -75.62 -8.09 55.92 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.595 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -87.49 16.09 5.88 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.029 0.442 . . . . 0.0 111.238 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.604 ' HE1' HD22 ' A' ' 25' ' ' LEU . 58.9 t80 -83.33 127.9 34.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.672 179.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -104.32 154.42 17.58 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.067 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -65.09 141.77 58.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.874 0.369 . . . . 0.0 111.349 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 26.9 m -128.52 159.73 39.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.886 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 6.1 mp -95.3 137.16 34.73 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.378 -0.373 . . . . 0.0 110.744 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.7 m -80.03 125.64 81.34 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.882 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -70.61 151.38 64.2 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.724 2.282 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.2 m -93.43 -0.05 56.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.299 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.0 mt-10 -99.48 140.29 33.89 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.79 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -147.51 156.19 42.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.802 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.9 m -95.2 -2.05 50.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.394 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -92.44 93.45 8.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.041 0.448 . . . . 0.0 110.254 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -100.78 0.99 39.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.5 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -63.09 -41.54 99.43 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.357 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.499 -1.167 . . . . 0.0 112.663 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 121.014 0.435 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -105.28 126.69 52.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.365 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -119.8 142.23 48.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.517 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 91.9 173.39 42.45 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.601 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.0 m -130.75 150.5 51.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.695 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtm -105.81 137.8 43.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.506 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.66 -40.58 97.51 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.922 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 85.07 179.98 50.97 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.553 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -106.19 117.98 35.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.627 0.251 . . . . 0.0 110.749 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 36' ' ' VAL . 97.3 m -64.93 -40.31 94.85 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.531 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 119.92 -175.25 15.83 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.235 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -106.68 120.98 43.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.728 0.264 . . . . 0.0 110.919 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -137.64 167.26 22.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.015 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.439 ' HA2' ' OD1' ' A' ' 109' ' ' ASN . . . 103.81 -17.18 49.95 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.83 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -104.14 -70.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.924 0.393 . . . . 0.0 110.514 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.1 mt -109.84 139.08 45.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.261 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.2 p -103.53 110.04 21.93 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.059 0.457 . . . . 0.0 110.839 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.92 -7.25 54.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.162 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -105.25 21.27 17.43 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.209 -179.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.3 m -70.79 120.03 15.8 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.12 164.45 20.29 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.484 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 66.1 tp -63.43 -50.37 70.03 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.62 -35.36 14.27 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.143 0.496 . . . . 0.0 111.589 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -103.61 70.8 1.04 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.46 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.0 mt -43.51 157.51 0.26 Allowed Pre-proline 0 N--CA 1.47 0.559 0 O-C-N 124.283 0.989 . . . . 0.0 112.454 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -42.32 167.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.151 0 C-N-CA 124.621 3.547 . . . . 0.0 113.845 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.73 -9.32 0.09 OUTLIER 'Trans proline' 0 C--N 1.359 1.124 0 C-N-CA 123.821 3.014 . . . . 0.0 115.083 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.5 -35.36 67.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 117.868 0.303 . . . . 0.0 110.937 179.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.834 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.0 tp -107.24 -77.55 0.6 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.06 -49.75 71.11 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 -178.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.34 -52.29 54.08 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.559 -0.829 . . . . 0.0 115.049 -177.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.8 tm-20 -71.28 -43.82 66.42 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 91.6 mt -66.68 -39.58 88.2 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.634 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 19.2 p -74.32 -32.97 63.03 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.191 -0.604 . . . . 0.0 112.17 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.7 -54.52 4.48 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.458 HG11 ' HG2' ' A' ' 102' ' ' ARG . 56.9 t -64.19 -44.83 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.512 ' HB2' ' NZ ' ' A' ' 71' ' ' LYS . 74.2 mt -75.64 -17.23 60.06 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 120.954 -0.299 . . . . 0.0 111.37 -178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 36.5 t0 -60.66 -37.13 80.56 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.054 0.454 . . . . 0.0 110.967 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.9 m -85.72 9.6 15.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.128 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.426 ' SG ' HD12 ' A' ' 44' ' ' LEU . 48.3 t -66.18 144.66 56.51 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.254 0.549 . . . . 0.0 111.883 -179.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -133.63 46.26 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.87 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.4 -11.99 70.51 Favored Glycine 0 CA--C 1.519 0.33 0 CA-C-N 115.649 -0.705 . . . . 0.0 113.391 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.82 -42.46 97.65 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.956 0.407 . . . . 0.0 111.551 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.426 HD12 ' SG ' ' A' ' 40' ' ' CYS . 0.4 OUTLIER -117.05 -26.15 6.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.308 179.095 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.403 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.63 108.07 0.25 Allowed Glycine 0 N--CA 1.447 -0.588 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.165 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.496 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 16.0 p90 -54.89 -40.3 69.62 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 117.211 0.505 . . . . 0.0 111.125 178.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.607 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -83.04 1.06 41.99 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.996 178.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.71 -43.52 96.31 Favored Glycine 0 C--N 1.329 0.177 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.713 -178.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.561 HD12 ' HB ' ' A' ' 74' ' ' THR . 94.2 mt -71.41 -42.4 68.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.768 0.318 . . . . 0.0 111.003 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.54 -40.59 93.06 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 179.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.03 -41.11 97.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.996 -178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -41.11 96.9 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.854 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.472 ' HA ' HD22 ' A' ' 53' ' ' LEU . 0.7 OUTLIER -71.09 -42.69 69.02 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.159 179.372 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 t 56.89 61.55 2.57 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.848 179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.9 p -65.28 -39.91 93.2 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.847 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 87.5 p -161.25 159.96 29.31 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.82 0.343 . . . . 0.0 111.06 179.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 77.5 t-105 -65.7 -42.75 90.82 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.831 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.78 1.48 38.75 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.6 -39.06 86.73 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.259 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.832 ' HA ' HD12 ' A' ' 63' ' ' ILE . 29.0 m -62.45 -26.9 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -63.24 -45.8 89.86 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.992 0.425 . . . . 0.0 110.672 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.4 t60 -74.38 -22.43 59.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.419 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.832 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.6 mt -59.86 -43.73 92.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-O 121.11 0.481 . . . . 0.0 110.5 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.517 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.9 mt-10 -66.94 -36.58 82.54 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.957 0.408 . . . . 0.0 110.935 178.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.34 -47.2 83.15 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -177.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 6.1 mt-10 -90.05 -4.08 57.59 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.1 p -56.54 -32.62 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 118.209 0.459 . . . . 0.0 111.235 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.82 -4.73 58.41 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.853 178.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -106.08 21.31 17.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.907 -178.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.64 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.62 21.15 10.01 Favored Glycine 0 CA--C 1.52 0.37 0 C-N-CA 120.259 -0.972 . . . . 0.0 114.233 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.64 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.0 OUTLIER 98.9 148.01 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.568 1.147 . . . . 0.0 112.04 177.479 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.531 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 4.1 t -137.13 -37.26 0.65 Allowed 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.659 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.649 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -50.68 -62.8 4.94 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.931 -179.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.561 ' HB ' HD12 ' A' ' 49' ' ' LEU . 9.2 t -88.21 -36.06 16.99 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 117.266 0.533 . . . . 0.0 111.712 179.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -62.18 -47.27 85.24 Favored 'General case' 0 C--O 1.224 -0.284 0 N-CA-C 112.365 0.505 . . . . 0.0 112.365 -178.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.2 tt0 -62.58 -40.14 95.93 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.645 0.26 . . . . 0.0 110.641 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 50' ' ' ALA . 64.7 tp -61.51 -46.96 87.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.531 HD22 ' HG3' ' A' ' 84' ' ' LYS . 91.1 mt -72.26 -39.88 68.08 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.566 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -78.09 -6.77 55.71 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.9 p -57.86 -38.63 76.05 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.42 ' O ' ' HA ' ' A' ' 123' ' ' GLU . 67.0 m95 -87.38 -91.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.016 179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.94 -86.8 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -108.7 -57.87 2.08 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.834 ' HD2' HD23 ' A' ' 29' ' ' LEU . 23.2 ttpp -133.07 -43.84 0.87 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.94 176.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.2 t30 47.97 34.7 4.3 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.556 0.742 . . . . 0.0 111.911 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -139.45 168.14 20.49 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 64.8 p -124.84 158.59 33.07 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.528 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.775 HD13 HD13 ' A' ' 29' ' ' LEU . 1.2 mm -60.56 -37.66 75.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.924 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -60.91 -41.35 99.27 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.716 -179.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.47 -42.34 83.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.057 0.456 . . . . 0.0 111.036 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -75.59 -24.14 56.54 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.802 -179.476 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 63.5 tp -59.52 -42.14 91.57 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.945 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -62.09 -41.59 98.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.433 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.3 t -69.09 -41.24 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.062 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.706 HD13 HD12 ' A' ' 91' ' ' LEU . 2.0 mp -59.91 -42.96 95.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.253 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -63.9 -40.8 97.33 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.204 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.6 tp10 -63.95 -46.71 83.48 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 92.4 mmm -70.29 -38.57 75.04 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 91.73 40.0 5.41 Favored Glycine 0 CA--C 1.52 0.376 0 C-N-CA 120.446 -0.883 . . . . 0.0 113.266 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.416 ' CE1' ' HB3' ' A' ' 44' ' ' LEU . 99.0 m-70 -78.44 97.18 5.58 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.994 0.397 . . . . 0.0 110.588 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.526 ' O ' HG12 ' A' ' 104' ' ' ILE . 83.6 mtp180 -63.67 -41.83 98.13 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.691 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.458 ' HG2' HG11 ' A' ' 36' ' ' VAL . 6.5 tpm_? -65.41 -37.56 87.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.044 0.449 . . . . 0.0 111.666 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.05 -39.31 85.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.681 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.619 ' O ' HG22 ' A' ' 107' ' ' ILE . 36.9 pt -69.03 -25.76 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.429 -179.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -70.56 -39.97 73.64 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.863 0.364 . . . . 0.0 110.717 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.427 ' HB2' ' HG3' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -84.93 -22.8 29.11 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.737 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -61.97 -21.18 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-O 120.642 0.258 . . . . 0.0 111.328 -179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.4 t -65.77 -16.71 64.04 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.598 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . 0.439 ' OD1' ' HA2' ' A' ' 14' ' ' GLY . 27.4 m120 -78.1 -10.44 59.62 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.759 0.314 . . . . 0.0 111.421 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -71.88 137.92 47.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.528 179.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 128.34 -7.06 6.7 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.582 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -62.52 -39.5 93.75 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.034 0.445 . . . . 0.0 110.837 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 30.2 m -129.11 160.72 39.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.564 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 62.7 tp -87.63 126.16 34.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.585 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 74.6 m -70.1 147.05 95.48 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.922 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.67 146.8 55.53 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.375 2.05 . . . . 0.0 112.371 179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 94.1 p -87.61 -11.18 49.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.193 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -129.06 149.19 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.824 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 59.5 mtmt -77.42 153.73 33.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.546 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 89.5 p -66.14 -30.54 71.04 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.612 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 59.67 30.4 20.0 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.408 -179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -128.63 148.54 50.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.098 179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.42 ' HA ' ' O ' ' A' ' 81' ' ' TRP . 98.7 mt-10 -118.74 133.48 55.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 110.754 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.344 -1.254 . . . . 0.0 112.495 179.827 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 121.136 0.493 . . . . 0.0 110.99 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -149.35 158.27 44.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.719 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -127.87 148.19 50.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.731 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 121.57 105.87 1.95 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.234 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.8 p -157.62 167.08 31.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.609 0.242 . . . . 0.0 110.866 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 66.2 mtt -125.93 151.29 47.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.447 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.2 151.06 48.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.978 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.68 167.46 44.45 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.854 -0.688 . . . . 0.0 112.909 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -97.83 109.01 21.85 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.686 0.279 . . . . 0.0 110.661 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.8 t -121.9 129.36 52.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.438 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -70.37 145.86 41.47 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.913 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.81 30.13 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.856 0.36 . . . . 0.0 111.302 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -77.3 148.36 35.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.948 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -86.88 -174.25 49.09 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 120.95 -0.643 . . . . 0.0 113.051 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.12 -39.93 94.19 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 111.665 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.35 121.19 20.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.138 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -83.07 108.28 16.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.183 0.516 . . . . 0.0 111.471 -178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.61 -7.45 50.07 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.902 178.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -103.42 21.76 15.42 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.442 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.418 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.4 m -78.64 113.91 17.1 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.504 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 20.6 mt -155.96 165.58 36.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.005 178.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 65.6 tp -62.77 -49.46 74.91 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -83.27 -35.39 25.35 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.156 0.503 . . . . 0.0 112.007 -178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.504 ' OD2' ' HB2' ' A' ' 21' ' ' LEU . 0.6 OUTLIER -113.09 71.23 0.74 Allowed 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.703 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.44 HD13 ' CE1' ' A' ' 110' ' ' TYR . 86.1 mt -41.0 155.4 0.21 Allowed Pre-proline 0 CA--C 1.54 0.577 0 O-C-N 123.926 0.766 . . . . 0.0 112.008 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.418 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.2 Cg_exo -38.01 164.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.198 0 C-N-CA 125.041 3.827 . . . . 0.0 114.848 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -49.21 -9.17 0.1 Allowed 'Trans proline' 0 C--N 1.363 1.318 0 C-N-CA 124.131 3.221 . . . . 0.0 115.18 -178.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.607 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.94 -35.55 64.35 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 117.634 0.197 . . . . 0.0 110.521 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.7 tp -107.91 -79.12 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.21 -47.44 84.42 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -177.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.51 -51.12 60.69 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.523 -0.846 . . . . 0.0 114.14 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.7 tm-20 -70.96 -43.26 68.49 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 94.7 mt -67.59 -38.68 84.38 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.7 p -73.97 -30.85 62.72 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.644 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.5 -57.35 3.1 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 64.9 t -63.66 -45.58 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 HD12 ' A' ' 49' ' ' LEU . 84.0 mt -72.61 -19.51 61.45 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.485 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 37.0 t0 -61.29 -37.29 82.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.122 0.487 . . . . 0.0 110.28 178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -85.69 1.65 48.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.014 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 52.4 t -63.45 139.34 58.76 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.224 0.535 . . . . 0.0 111.553 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -128.52 45.78 2.71 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.938 -179.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.04 -10.96 73.01 Favored Glycine 0 CA--C 1.52 0.35 0 CA-C-N 115.535 -0.757 . . . . 0.0 113.127 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.11 98.76 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.994 0.397 . . . . 0.0 111.347 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -114.68 -23.6 9.15 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.78 110.37 0.3 Allowed Glycine 0 N--CA 1.443 -0.884 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.393 -178.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.9 p90 -50.95 -50.35 58.11 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 117.293 0.546 . . . . 0.0 110.627 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.656 ' HB3' HG21 ' A' ' 63' ' ' ILE . 47.0 ptt85 -84.04 1.33 44.41 Favored 'General case' 0 C--O 1.212 -0.895 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.694 177.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.91 -49.11 73.56 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.3 -177.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.511 HD12 HD11 ' A' ' 37' ' ' LEU . 95.9 mt -71.25 -41.63 69.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.073 0.437 . . . . 0.0 111.372 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.578 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -64.68 -41.4 96.08 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 112.588 0.588 . . . . 0.0 112.588 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -60.55 -42.63 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.934 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.3 mtt-85 -64.23 -41.3 97.06 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.106 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.774 HD23 HD21 ' A' ' 77' ' ' LEU . 56.7 tp -70.41 -45.56 65.69 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.439 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.0 m -146.18 140.02 26.31 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.786 0.327 . . . . 0.0 111.103 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.3 m -120.8 120.6 36.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.612 0.244 . . . . 0.0 110.748 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -158.1 141.34 15.11 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.61 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 77.1 t-105 -62.47 -45.31 93.63 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.207 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' A' ' 58' ' ' LEU . 3.1 mm? -65.56 -38.74 90.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.061 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -62.64 -45.8 91.17 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.148 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.789 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.4 m -70.49 -25.33 26.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 C-N-CA 120.924 -0.311 . . . . 0.0 111.816 -179.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -62.61 -45.11 94.4 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-O 121.174 0.511 . . . . 0.0 109.937 178.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -70.74 -27.72 64.16 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.842 178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.1 mt -59.97 -42.71 90.47 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.129 0.49 . . . . 0.0 110.572 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.532 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.4 mt-10 -65.92 -36.53 83.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.458 . . . . 0.0 110.847 178.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -63.53 -49.14 74.7 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -178.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.551 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 1.4 mm-40 -89.95 -3.45 58.03 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -178.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.532 HG12 ' O ' ' A' ' 64' ' ' GLU . 6.2 p -56.18 -33.42 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 118.177 0.444 . . . . 0.0 111.18 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.05 -4.34 58.4 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.808 0.337 . . . . 0.0 110.762 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -105.97 21.57 17.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.883 -178.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.86 20.79 10.24 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.282 -0.961 . . . . 0.0 114.269 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.0 OUTLIER 95.82 141.52 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.388 1.075 . . . . 0.0 112.161 177.493 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.7 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.4 t -131.12 -28.8 1.9 Allowed 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.331 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.486 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -56.23 -63.14 5.58 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.958 -1.115 . . . . 0.0 111.745 179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.505 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.84 -40.12 13.36 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 179.224 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.55 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 76.9 ttt180 -62.31 -49.89 73.83 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -177.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.7 ' HB3' ' O ' ' A' ' 72' ' ' SER . 52.4 tp10 -64.51 -39.19 93.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.295 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.774 HD21 HD23 ' A' ' 53' ' ' LEU . 64.0 tp -60.51 -46.52 89.82 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.937 0.399 . . . . 0.0 110.338 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.487 HD22 ' HG3' ' A' ' 84' ' ' LYS . 85.7 mt -71.5 -39.59 70.73 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.195 0.522 . . . . 0.0 111.197 179.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -74.55 -6.47 48.65 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.616 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 t -58.03 -42.1 84.63 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 61.5 m95 -85.73 -90.05 0.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.988 179.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.71 -86.26 0.5 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.216 0.532 . . . . 0.0 109.575 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.48 -56.95 2.34 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.921 ' HD2' HD23 ' A' ' 29' ' ' LEU . 21.5 ttpp -132.02 -42.68 0.99 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.482 176.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 45.63 34.01 1.6 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.669 0.788 . . . . 0.0 112.563 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.427 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -138.5 169.01 18.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.3 p -119.38 158.32 26.41 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.469 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.3 mp -59.23 -38.26 73.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.057 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.31 -39.6 97.95 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 121.037 -0.601 . . . . 0.0 112.824 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.83 -46.53 87.5 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.752 0.279 . . . . 0.0 111.752 -179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.681 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.2 mm? -76.32 -24.49 54.31 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.286 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.0 tp -59.07 -38.1 78.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -60.93 -41.83 96.98 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.839 -179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.9 m -83.09 -23.95 8.3 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 120.828 -0.349 . . . . 0.0 111.121 179.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.522 HD13 ' O ' ' A' ' 91' ' ' LEU . 2.8 mp -62.78 -46.61 87.21 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.006 0.432 . . . . 0.0 110.334 178.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -65.69 -39.44 91.28 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.626 179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -63.29 -43.5 97.7 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.652 179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 10.6 tpt -68.69 -38.75 80.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.1 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 95.88 22.86 19.51 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.095 -179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -78.08 99.02 5.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.087 0.47 . . . . 0.0 110.996 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 90.2 mtm180 -64.69 -40.8 96.01 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.809 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -61.19 -41.4 96.74 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 120.856 0.36 . . . . 0.0 110.739 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -39.49 90.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.304 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.627 ' O ' HG22 ' A' ' 107' ' ' ILE . 44.2 mm -63.97 -43.66 97.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.749 179.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 81.6 m-70 -64.64 -40.78 96.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.648 179.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -79.79 -22.78 42.72 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.627 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.5 tp -64.55 -20.84 27.97 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.511 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.1 p -74.09 -10.18 59.36 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.65 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -89.03 16.28 7.32 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.195 0.522 . . . . 0.0 111.187 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.44 ' CE1' HD13 ' A' ' 25' ' ' LEU . 38.7 t80 -88.54 127.17 35.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.307 179.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -147.62 77.9 0.24 Allowed Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.887 179.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -149.73 168.13 24.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.847 0.356 . . . . 0.0 111.33 -179.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 4.9 m -89.11 36.02 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.142 -0.481 . . . . 0.0 112.277 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.92 -168.3 0.15 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.292 0.637 . . . . 0.0 111.795 179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 63.4 m -129.37 150.49 75.72 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.513 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -70.81 154.62 63.48 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.474 2.116 . . . . 0.0 112.382 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 64.1 m -105.67 141.81 36.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.834 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -125.82 145.75 50.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.637 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -126.93 149.6 49.73 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.585 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 98.7 p -150.24 160.74 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.611 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 54.5 p90 -149.1 161.53 41.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.486 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -150.12 159.5 44.37 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.668 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -64.68 -39.4 93.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.165 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.408 -1.218 . . . . 0.0 112.504 -179.949 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.92 0.391 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -124.76 145.61 49.63 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.561 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -150.31 160.78 43.47 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.645 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -76.68 146.53 32.74 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.498 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.4 m -102.68 85.48 2.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.845 0.355 . . . . 0.0 111.03 -179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.6 mmt -123.13 140.53 52.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.116 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -148.77 151.54 34.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.779 0.323 . . . . 0.0 111.238 -179.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -104.11 -168.22 25.0 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.032 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -136.86 103.43 5.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -150.71 137.28 18.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.713 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -95.62 -160.14 33.07 Favored Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.606 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.76 147.07 53.97 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.448 0.166 . . . . 0.0 110.934 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -61.03 -46.85 89.04 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 154.0 169.93 19.41 Favored Glycine 0 CA--C 1.517 0.206 0 C-N-CA 120.299 -0.953 . . . . 0.0 113.113 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.35 -39.54 92.47 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -102.54 159.89 15.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.753 -179.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.463 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 2.8 p -95.91 109.06 21.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.083 0.468 . . . . 0.0 111.692 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.93 -10.23 40.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.241 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -103.79 21.6 15.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.369 -178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 35.2 m -67.64 119.66 12.76 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 120.74 0.305 . . . . 0.0 111.72 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.17 163.3 22.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.428 179.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.0 tp -64.38 -50.58 67.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -85.25 -35.38 21.6 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.565 0.697 . . . . 0.0 111.325 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.5 70.44 0.73 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.348 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD22 ' HE1' ' A' ' 110' ' ' TYR . 94.7 mt -45.84 155.52 0.49 Allowed Pre-proline 0 N--CA 1.466 0.356 0 O-C-N 124.161 0.913 . . . . 0.0 111.387 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -35.4 160.8 0.01 OUTLIER 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 124.683 3.589 . . . . 0.0 114.888 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.463 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 85.3 Cg_exo -49.39 -9.17 0.11 Allowed 'Trans proline' 0 C--N 1.358 1.056 0 C-N-CA 124.338 3.359 . . . . 0.0 114.889 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.629 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.32 -35.05 62.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 117.71 0.232 . . . . 0.0 110.676 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.928 HD23 ' HD2' ' A' ' 84' ' ' LYS . 7.5 tp -107.85 -78.28 0.59 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 63.0 tp -61.32 -48.73 80.01 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.64 -52.73 48.93 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.676 -0.773 . . . . 0.0 114.817 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -72.2 -42.01 66.27 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 95' ' ' LEU . 92.6 mt -65.4 -38.76 90.93 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.675 -179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.6 p -72.15 -29.46 64.06 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.357 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 38' ' ' ASP . . . -85.53 -59.42 2.32 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -178.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.9 t -64.03 -44.44 97.79 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 33' ' ' LEU . 89.6 mt -70.81 -19.17 62.7 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.649 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.411 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 13.6 t70 -60.99 -37.15 81.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.982 0.42 . . . . 0.0 110.625 178.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.6 m -81.22 1.56 31.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.149 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.442 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 50.3 t -64.16 139.01 58.72 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.316 0.579 . . . . 0.0 111.916 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.0 t0 -129.4 43.67 3.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.358 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 95.26 -13.84 66.16 Favored Glycine 0 CA--C 1.521 0.424 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.791 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.97 -42.88 97.12 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.762 0.315 . . . . 0.0 111.704 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 83.5 mt -112.61 -17.34 12.64 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.113 179.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.442 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 72.49 105.54 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.549 -179.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.476 ' HB3' ' HZ2' ' A' ' 71' ' ' LYS . 7.8 p90 -51.63 -52.51 47.19 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 117.361 0.581 . . . . 0.0 110.338 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HB3' HG21 ' A' ' 63' ' ' ILE . 49.1 ptt85 -84.7 -0.32 53.14 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.651 177.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.41 -39.05 92.34 Favored Glycine 0 N--CA 1.46 0.276 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.87 -178.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.455 HD11 HD13 ' A' ' 37' ' ' LEU . 0.1 OUTLIER -85.15 -45.41 12.08 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.787 0.327 . . . . 0.0 110.713 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.58 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -62.78 -40.49 97.48 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -61.41 -41.16 96.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.011 -178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -64.47 -40.8 96.38 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.368 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.721 HD23 HD21 ' A' ' 77' ' ' LEU . 56.5 tp -69.17 -44.13 72.86 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 120.911 0.386 . . . . 0.0 110.609 179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.5 m -139.67 125.09 19.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.167 178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.3 m -109.36 111.22 22.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.951 0.405 . . . . 0.0 111.508 -179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 68.8 m -143.1 143.92 32.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.197 178.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 62.7 p-90 -81.32 -11.26 59.38 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.21 -32.33 12.51 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.645 0.26 . . . . 0.0 111.484 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.53 ' HA ' ' CE1' ' A' ' 62' ' ' HIS . 99.0 m-20 -62.78 -38.65 91.45 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.825 ' HA ' HD12 ' A' ' 63' ' ' ILE . 32.5 m -64.76 -19.79 26.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -64.18 -46.36 84.32 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.695 0.283 . . . . 0.0 110.954 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.53 ' CE1' ' HA ' ' A' ' 59' ' ' ASP . 18.7 p-80 -85.68 -14.71 44.64 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.825 HD12 ' HA ' ' A' ' 60' ' ' VAL . 76.4 mt -59.8 -40.43 82.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 121.406 0.622 . . . . 0.0 109.518 178.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.455 ' O ' HG12 ' A' ' 67' ' ' VAL . 97.6 mt-10 -72.13 -21.33 61.48 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.601 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -73.85 -52.7 12.18 Favored 'General case' 0 N--CA 1.467 0.416 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.562 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 18.1 mt-10 -86.85 -3.51 59.08 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 64' ' ' GLU . 9.2 p -57.36 -34.31 45.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.914 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -89.58 -4.52 57.81 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 121.07 0.462 . . . . 0.0 110.571 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -107.12 22.75 15.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.717 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 105.11 20.4 9.8 Favored Glycine 0 CA--C 1.523 0.548 0 C-N-CA 120.302 -0.951 . . . . 0.0 114.037 -179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 92.79 141.77 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.364 1.065 . . . . 0.0 112.155 177.168 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.575 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.2 t -130.18 -28.64 2.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.037 178.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -57.28 -64.49 4.34 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.072 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.453 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -87.68 -36.33 17.48 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.51 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.8 ttt180 -61.66 -47.98 82.89 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.622 -178.303 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.527 ' HB3' ' O ' ' A' ' 72' ' ' SER . 13.3 tm-20 -62.55 -40.71 97.69 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.62 0.248 . . . . 0.0 110.647 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.721 HD21 HD23 ' A' ' 53' ' ' LEU . 63.4 tp -60.55 -46.65 89.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.177 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.524 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.4 mt -70.37 -39.11 74.77 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 120.89 0.376 . . . . 0.0 111.721 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -78.35 -4.93 50.55 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.9 m -58.12 -40.16 80.54 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 -178.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 90.1 m95 -86.54 -90.39 0.11 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.983 179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.3 -86.92 0.5 Allowed 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -110.6 -56.97 2.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.928 ' HD2' HD23 ' A' ' 29' ' ' LEU . 19.3 ttpp -132.54 -43.7 0.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.2 176.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.8 t30 48.03 35.74 5.49 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.702 0.801 . . . . 0.0 111.605 179.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.474 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.43 171.24 14.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.713 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.3 p -123.78 158.42 31.79 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.221 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 107' ' ' ILE . 1.8 mp -59.63 -41.28 84.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.268 -179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.19 -39.8 98.14 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.815 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.47 -45.89 88.72 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.526 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -76.28 -24.88 54.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.456 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.435 HD13 HD13 ' A' ' 107' ' ' ILE . 62.5 tp -58.96 -41.3 87.17 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.177 -179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.13 -42.81 99.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.855 0.359 . . . . 0.0 110.956 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 79.5 t -70.52 -43.63 77.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 121.294 0.569 . . . . 0.0 110.696 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.795 HD21 HD21 ' A' ' 33' ' ' LEU . 7.1 mp -61.83 -38.62 88.87 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.199 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -60.09 -39.98 88.02 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.767 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.3 tp10 -62.77 -44.51 95.99 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.424 179.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.4 mmm -69.87 -38.89 76.54 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 104.32 42.6 1.87 Allowed Glycine 0 CA--C 1.523 0.55 0 C-N-CA 119.79 -1.195 . . . . 0.0 113.291 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.726 ' HB2' ' HB3' ' A' ' 103' ' ' ALA . 26.8 p-80 -56.78 111.67 1.09 Allowed 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.181 0.515 . . . . 0.0 112.355 -179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -85.4 -64.37 1.17 Allowed 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -65.94 -35.87 81.79 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.043 -178.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.726 ' HB3' ' HB2' ' A' ' 100' ' ' HIS . . . -57.89 -32.14 67.42 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.557 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.492 ' O ' HG22 ' A' ' 107' ' ' ILE . 87.1 mt -60.13 -40.54 83.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-O 121.205 0.526 . . . . 0.0 109.878 178.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 65.7 t-80 -59.45 -48.34 82.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.561 -179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.5 -25.46 28.82 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -178.52 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.629 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 13.1 tt -61.59 -20.71 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 O-C-N 122.166 -0.334 . . . . 0.0 111.315 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 78.3 p -71.8 -10.15 59.35 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.384 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.93 -27.71 66.0 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.863 0.363 . . . . 0.0 111.051 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.498 ' HE1' HD22 ' A' ' 25' ' ' LEU . 82.2 t80 -85.73 109.42 18.61 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.881 0.372 . . . . 0.0 110.072 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -144.33 22.87 2.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.73 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -149.19 158.96 44.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.577 0.227 . . . . 0.0 110.849 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 27.0 m -126.55 156.56 37.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.774 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 88.6 mt -117.07 141.52 48.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.617 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 51.1 m -108.51 112.73 60.67 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.78 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -77.63 64.59 8.11 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.572 2.181 . . . . 0.0 112.735 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.9 m -90.47 -4.87 56.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.159 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 48.7 mp0 -73.77 140.99 46.28 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -126.25 147.24 49.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.629 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 60.8 m -126.7 145.72 50.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.432 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -127.65 145.54 50.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.574 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -65.05 -39.38 93.21 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.387 179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.6 mt-10 -127.56 146.45 50.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.431 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.207 0 CA-C-O 118.167 -1.352 . . . . 0.0 112.306 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.638 0.256 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 57.46 50.51 11.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.597 -0.728 . . . . 0.0 112.129 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -64.23 -39.32 93.71 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.37 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 83.02 4.09 90.14 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.821 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.5 m -62.94 -40.04 96.43 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.804 0.335 . . . . 0.0 111.519 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.0 ttp -88.1 78.18 8.21 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.038 0.446 . . . . 0.0 110.499 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.23 -40.96 97.11 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.47 179.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 90.57 165.45 40.39 Favored Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.643 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -159.2 150.8 20.44 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.1 m -122.02 145.63 47.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.769 0.318 . . . . 0.0 111.102 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 176.67 177.74 45.88 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.005 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -157.41 151.2 24.26 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 17.3 tpt180 -116.6 -70.43 0.79 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 121.096 -0.242 . . . . 0.0 110.743 179.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -165.09 156.7 28.82 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.616 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.28 -39.77 93.02 Favored 'General case' 0 N--CA 1.464 0.271 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -107.63 148.6 29.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.2 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.7 p -80.12 110.62 15.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.098 0.475 . . . . 0.0 111.479 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 -10.04 46.66 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.103 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -104.35 21.74 16.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.564 -179.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.1 m -66.88 114.98 6.14 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 120.747 0.308 . . . . 0.0 111.771 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -165.71 174.2 9.98 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.729 178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.1 mp -79.84 -57.63 3.56 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -72.24 -35.85 68.94 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.532 0.682 . . . . 0.0 110.808 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -111.85 69.96 0.7 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.243 178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -46.34 156.02 0.52 Allowed Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.451 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -37.53 163.5 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.15 0 C-N-CA 124.854 3.703 . . . . 0.0 114.635 -179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.77 -8.71 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 124.386 3.39 . . . . 0.0 115.027 -178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.706 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.87 -35.85 64.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 117.919 0.327 . . . . 0.0 110.532 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.941 HD23 ' HD2' ' A' ' 84' ' ' LYS . 5.9 tp -108.1 -78.49 0.59 Allowed 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.1 tp -61.55 -47.35 85.94 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -177.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -62.89 -52.2 49.95 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 120.692 -0.766 . . . . 0.0 114.988 -178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.447 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 32.3 tp10 -72.71 -43.7 62.69 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -178.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.11 -40.72 94.9 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.435 -0.506 . . . . 0.0 112.324 -178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.671 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 67.6 m -70.79 -43.84 67.86 Favored 'General case' 0 C--O 1.223 -0.321 0 C-N-CA 119.764 -0.774 . . . . 0.0 111.45 -179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.75 -50.48 24.23 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.2 t -68.17 -43.38 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 N-CA-C 113.238 0.829 . . . . 0.0 113.238 -178.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.584 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 84.7 mt -78.77 -15.9 57.85 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.626 -179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.671 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.4 t70 -58.77 -39.46 81.06 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.148 0.499 . . . . 0.0 110.8 178.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.5 m -90.53 10.03 27.05 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.023 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.1 t -68.13 142.43 55.76 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.072 0.463 . . . . 0.0 111.259 -179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -137.92 57.66 1.71 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.178 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.46 -10.97 73.2 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.82 -0.627 . . . . 0.0 113.554 179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.29 -43.33 98.19 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.255 0.527 . . . . 0.0 111.019 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -126.14 -32.87 2.7 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.88 115.39 1.83 Allowed Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.098 -0.955 . . . . 0.0 111.625 -179.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.6 p90 -54.38 -46.08 72.97 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 117.226 0.513 . . . . 0.0 110.846 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.404 ' HB3' HD13 ' A' ' 63' ' ' ILE . 46.9 ptt85 -83.49 -0.09 48.67 Favored 'General case' 0 C--O 1.212 -0.914 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 177.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.73 -47.65 89.19 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.297 -0.954 . . . . 0.0 113.465 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 95.3 mt -72.15 -42.66 65.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 117.055 0.427 . . . . 0.0 111.217 179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.478 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -65.48 -39.87 92.45 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -60.19 -44.34 95.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.311 -178.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.5 mtt-85 -65.93 -40.5 91.46 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 112.026 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 77' ' ' LEU . 0.9 OUTLIER -74.8 -39.96 61.4 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.4 m -92.2 -169.65 2.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.016 0.436 . . . . 0.0 111.621 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 88.2 p -135.81 156.05 49.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.201 179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.2 t 70.85 164.77 0.28 Allowed 'General case' 0 N--CA 1.47 0.546 0 O-C-N 123.792 0.683 . . . . 0.0 111.235 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.515 ' O ' HG22 ' A' ' 60' ' ' VAL . 32.1 m-90 -111.38 8.02 21.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.675 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 97.1 mt -70.79 -28.59 64.76 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.127 0.489 . . . . 0.0 111.175 179.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -65.25 -20.21 66.32 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -178.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.815 ' HA ' HD12 ' A' ' 63' ' ' ILE . 16.1 m -61.35 -20.15 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -60.07 -47.89 83.97 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.585 0.231 . . . . 0.0 111.012 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.439 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.7 t60 -73.87 -28.25 61.48 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.632 178.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.815 HD12 ' HA ' ' A' ' 60' ' ' VAL . 85.2 mt -59.54 -41.55 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 121.289 0.566 . . . . 0.0 110.32 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.473 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.9 mm-40 -67.09 -34.96 78.77 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.963 0.411 . . . . 0.0 111.114 178.491 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.4 mttt -62.53 -49.21 76.24 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -177.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.525 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.2 mt-10 -89.47 -3.64 58.29 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -178.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -54.86 -28.7 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 118.116 0.416 . . . . 0.0 111.502 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.68 -4.73 58.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.825 0.345 . . . . 0.0 111.179 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -106.47 22.32 16.0 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.895 -178.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.727 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.03 12.01 30.72 Favored Glycine 0 C--N 1.329 0.156 0 CA-C-O 118.567 -1.129 . . . . 0.0 113.605 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.727 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.8 tppp? 108.34 149.02 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.97 1.308 . . . . 0.0 112.227 177.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.632 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -134.36 -19.79 1.9 Allowed 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.495 177.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -60.78 -67.76 1.98 Allowed Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.605 -1.283 . . . . 0.0 111.72 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 6.2 m -88.11 -33.85 18.11 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.508 -0.407 . . . . 0.0 111.057 179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 -61.44 -45.74 93.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.839 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.488 ' HB3' ' O ' ' A' ' 72' ' ' SER . 84.9 tt0 -61.68 -41.57 97.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.602 0.239 . . . . 0.0 110.477 179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.451 HD22 ' HA ' ' A' ' 50' ' ' ALA . 65.1 tp -61.76 -46.24 90.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.922 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.533 HD22 ' HG3' ' A' ' 84' ' ' LYS . 89.5 mt -67.69 -39.23 84.44 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.872 0.368 . . . . 0.0 111.145 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -80.96 -4.94 56.75 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.2 m -58.45 -40.05 81.58 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -86.26 -89.61 0.11 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 120.719 -0.393 . . . . 0.0 110.905 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -86.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.121 0.486 . . . . 0.0 109.745 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -114.29 -54.64 2.57 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.941 ' HD2' HD23 ' A' ' 29' ' ' LEU . 18.5 ttpp -132.26 -43.9 0.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.6 t30 47.41 34.87 3.57 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.826 0.85 . . . . 0.0 111.703 178.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.29 170.79 15.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.648 -179.1 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.0 p -122.86 158.6 29.94 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.036 179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.456 HG13 HD13 ' A' ' 29' ' ' LEU . 1.3 mp -59.39 -38.18 73.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.08 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.76 -39.57 98.13 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.104 -0.57 . . . . 0.0 112.756 178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -63.22 -46.43 87.03 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.649 ' CB ' HD11 ' A' ' 29' ' ' LEU . 1.1 mm? -74.18 -24.13 59.33 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.154 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.6 tp -59.16 -37.66 77.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.061 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -61.0 -41.69 97.02 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.836 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.65 -23.26 8.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.183 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 91' ' ' LEU . 1.6 mp -63.42 -41.09 98.7 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.026 0.441 . . . . 0.0 109.843 178.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -65.77 -37.75 87.17 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.558 178.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -61.65 -40.52 95.2 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.68 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.4 mmt -89.42 -12.97 38.73 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.608 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 70.83 37.97 65.83 Favored Glycine 0 CA--C 1.52 0.401 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.748 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.474 ' ND1' ' HB2' ' A' ' 103' ' ' ALA . 19.3 t-160 -78.05 95.29 4.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.318 0.559 . . . . 0.0 110.218 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -64.63 -40.86 96.21 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.237 -0.892 . . . . 0.0 113.096 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 5.4 tpm_? -61.19 -39.89 91.89 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.688 0.28 . . . . 0.0 111.291 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.521 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.31 -38.78 88.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.397 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.576 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -62.15 -42.95 97.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.953 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -63.38 -40.8 98.22 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.456 HD22 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -84.16 -21.77 31.22 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.706 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.7 tp -61.72 -21.0 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-O 120.696 0.284 . . . . 0.0 111.514 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.5 t -67.86 -13.94 62.55 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -74.29 -10.82 59.97 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.742 0.306 . . . . 0.0 111.665 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -66.59 138.67 57.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.033 0.444 . . . . 0.0 111.143 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.33 14.87 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.695 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.96 -39.47 92.23 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.816 0.341 . . . . 0.0 111.666 179.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 30.3 m -74.56 -17.59 16.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.029 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 83.7 mt 70.88 -55.71 0.64 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.43 0.692 . . . . 0.0 112.168 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.0 m -120.01 97.38 49.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.537 0.208 . . . . 0.0 111.439 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -72.72 157.01 52.79 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.656 2.237 . . . . 0.0 112.236 179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 82.6 p -64.59 -34.34 78.03 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.826 0.346 . . . . 0.0 111.664 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -119.76 144.71 47.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.557 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt 57.65 41.53 25.33 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 123.734 0.646 . . . . 0.0 111.545 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 91.7 p -74.79 162.0 29.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.155 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -120.87 127.98 52.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.594 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -125.82 144.69 50.54 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.408 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -112.67 126.74 55.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.517 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.972 0 CA-C-O 118.507 -1.163 . . . . 0.0 112.303 -179.951 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.46 0 CA-C-O 120.551 0.215 . . . . 0.0 110.815 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 59.0 47.35 12.27 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.11 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -146.52 160.65 41.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.433 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.98 2.39 90.67 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.886 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.2 m -85.85 73.42 10.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.911 0.386 . . . . 0.0 110.982 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 39.1 mmt -84.52 141.2 30.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.807 179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -71.14 139.38 50.23 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.188 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.95 -175.4 42.55 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.551 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -64.94 130.87 44.98 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.525 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 74.3 m 65.34 20.34 11.81 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 123.697 0.623 . . . . 0.0 111.559 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.74 -41.55 98.89 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.346 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.81 156.98 35.71 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.612 0.244 . . . . 0.0 111.114 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.43 158.47 42.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.518 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -178.52 164.6 33.28 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.075 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.57 -89.19 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.004 0.522 . . . . 0.0 111.749 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.43 160.65 16.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.591 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 1.7 p -72.64 108.53 5.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.065 0.459 . . . . 0.0 110.586 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.95 -6.5 53.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.996 179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.525 ' NE2' ' HA ' ' A' ' 10' ' ' CYS . 79.8 m80 -104.47 21.53 16.55 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.203 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.508 HG23 ' HD3' ' A' ' 26' ' ' PRO . 32.4 m -76.42 122.6 24.75 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 111.898 0.333 . . . . 0.0 111.898 -179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -164.29 166.88 20.48 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.438 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.449 HD12 ' HB3' ' A' ' 114' ' ' LEU . 68.5 tp -63.66 -49.81 71.76 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -179.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -84.84 -33.73 22.81 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.344 0.593 . . . . 0.0 111.292 -179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.3 72.47 0.78 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.529 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 114' ' ' LEU . 77.2 mt -46.73 156.83 0.5 Allowed Pre-proline 0 CA--C 1.541 0.599 0 O-C-N 123.415 0.447 . . . . 0.0 111.282 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' HD3' HG23 ' A' ' 20' ' ' THR . 6.3 Cg_exo -37.78 162.2 0.02 OUTLIER 'Trans proline' 0 C--N 1.364 1.342 0 C-N-CA 124.877 3.718 . . . . 0.0 115.126 -178.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 87.7 Cg_exo -49.13 -9.35 0.1 Allowed 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 124.338 3.359 . . . . 0.0 115.11 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -54.38 -35.02 62.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 117.825 0.284 . . . . 0.0 110.998 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.824 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.1 tp -108.49 -78.28 0.59 Allowed 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 179.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 61.6 tp -61.66 -48.44 80.79 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -60.9 -51.74 56.72 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 120.645 -0.788 . . . . 0.0 114.249 -178.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 46.3 tp10 -70.21 -44.03 69.47 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.403 HD21 HD21 ' A' ' 95' ' ' LEU . 96.2 mt -68.39 -39.0 81.84 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.4 p -71.82 -30.93 66.01 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.689 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.14 -56.76 3.38 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.5 t -64.69 -44.71 96.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.85 -18.04 61.48 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 120.648 -0.421 . . . . 0.0 111.607 -179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.447 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 12.7 t70 -58.41 -38.56 77.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.031 0.443 . . . . 0.0 110.755 179.133 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.5 m -90.39 7.72 37.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.095 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 47.0 t -65.75 140.63 58.45 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.229 0.537 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -135.46 54.61 1.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.145 -179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 92.66 -10.58 73.8 Favored Glycine 0 CA--C 1.519 0.318 0 CA-C-N 115.692 -0.685 . . . . 0.0 113.607 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.52 98.2 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 117.255 0.528 . . . . 0.0 111.007 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' A' ' 44' ' ' LEU . 1.8 mm? -123.4 -26.63 4.22 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 178.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.76 114.86 0.83 Allowed Glycine 0 N--CA 1.444 -0.78 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.755 -179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.409 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 p90 -53.58 -46.47 70.34 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 117.191 0.495 . . . . 0.0 110.403 178.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.438 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.8 ptt85 -83.75 1.33 43.32 Favored 'General case' 0 C--O 1.213 -0.865 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.797 177.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.9 -44.86 94.22 Favored Glycine 0 C--O 1.23 -0.134 0 C-N-CA 120.29 -0.957 . . . . 0.0 113.252 -177.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.456 HD21 HD23 ' A' ' 95' ' ' LEU . 93.1 mt -72.88 -43.51 62.42 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 117.036 0.418 . . . . 0.0 111.194 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.763 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.37 -39.55 92.42 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -60.48 -42.87 97.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.048 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.14 -41.79 99.35 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.544 -179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.998 HD23 HD11 ' A' ' 77' ' ' LEU . 52.1 tp -67.76 -40.14 84.1 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.604 179.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.3 m 58.62 50.94 8.34 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.25 -0.432 . . . . 0.0 112.147 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p -63.75 -37.77 88.61 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.735 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.3 t -155.72 146.16 21.86 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.735 179.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -70.28 -31.29 68.58 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.47 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 93.5 mt -88.28 0.07 56.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.675 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.41 ' O ' HG13 ' A' ' 63' ' ' ILE . 36.8 t70 -61.13 -39.45 90.07 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.521 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.828 ' HA ' HD12 ' A' ' 63' ' ' ILE . 15.9 m -61.35 -27.92 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.249 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -63.26 -39.71 95.35 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.863 0.363 . . . . 0.0 111.24 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 15.0 t60 -84.04 -18.38 37.21 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.24 -179.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.828 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.6 mt -60.41 -41.49 87.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.089 0.471 . . . . 0.0 110.765 179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.515 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -64.64 -38.68 91.84 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.448 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 33.5 mttm -65.89 -46.15 79.43 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 -177.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.517 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.98 -3.81 57.8 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -178.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.3 p -56.11 -35.59 42.36 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-N 118.18 0.446 . . . . 0.0 111.392 -179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.36 -4.62 58.0 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.966 0.412 . . . . 0.0 110.862 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.0 mm100 -104.83 22.21 15.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.869 -178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.603 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.54 21.48 9.22 Favored Glycine 0 CA--C 1.52 0.375 0 C-N-CA 120.409 -0.901 . . . . 0.0 114.191 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.603 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.31 141.13 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 124.302 1.041 . . . . 0.0 112.004 177.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.543 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.6 t -130.73 -30.74 1.82 Allowed 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.236 178.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.54 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.65 -64.33 4.43 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.309 -0.948 . . . . 0.0 112.316 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.486 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 22.8 m -87.74 -38.53 15.71 Favored 'General case' 0 C--N 1.321 -0.663 0 O-C-N 122.725 -0.279 . . . . 0.0 111.692 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.515 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.5 ttt180 -60.54 -48.36 82.13 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -177.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.543 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.9 tt0 -63.29 -39.68 95.24 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 120.772 0.32 . . . . 0.0 110.677 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.998 HD11 HD23 ' A' ' 53' ' ' LEU . 56.9 tp -61.08 -46.85 88.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.559 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.447 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 88.2 mt -71.31 -39.13 71.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.1 0.476 . . . . 0.0 111.19 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 17.3 t-105 -76.25 -7.03 53.99 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -178.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.7 p -57.66 -38.94 75.94 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -177.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 48.1 m95 -87.62 -89.76 0.13 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.484 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.67 -87.22 0.49 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -115.63 -52.37 2.64 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 177.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.824 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.5 ttpm? -132.25 -44.75 0.93 Allowed 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 176.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.0 t30 47.09 35.85 3.83 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.503 0.721 . . . . 0.0 111.307 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.36 170.32 16.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.986 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 61.9 p -119.27 155.24 32.15 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.462 HG23 HD11 ' A' ' 107' ' ' ILE . 1.7 mp -59.68 -39.72 80.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.608 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.93 -39.21 97.24 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.743 178.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -63.17 -45.84 89.94 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.607 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.68 -23.88 53.19 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 111.591 0.219 . . . . 0.0 111.591 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.494 HD13 HD13 ' A' ' 107' ' ' ILE . 62.8 tp -59.01 -41.65 88.25 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.037 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -62.2 -41.25 98.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.606 179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -69.17 -40.25 80.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.174 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.456 HD23 HD21 ' A' ' 49' ' ' LEU . 81.5 mt -61.62 -36.94 82.19 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.27 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -60.92 -39.68 90.32 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.854 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -63.44 -44.2 95.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 120.936 0.398 . . . . 0.0 110.408 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 37.4 mmt -68.87 -36.56 78.25 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.956 179.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 84.53 30.17 27.93 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.525 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.416 ' CE1' ' HB3' ' A' ' 102' ' ' ARG . 0.8 OUTLIER -74.41 97.33 3.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.147 0.498 . . . . 0.0 110.927 -179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.7 mtp180 -64.33 -41.66 96.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.663 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.416 ' HB3' ' CE1' ' A' ' 100' ' ' HIS . 25.8 tpp180 -62.16 -41.33 98.2 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 120.901 0.381 . . . . 0.0 110.872 -179.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.51 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.93 -39.11 88.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.24 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.599 ' O ' HG22 ' A' ' 107' ' ' ILE . 41.2 mm -62.41 -43.67 98.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.794 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 -63.55 -42.08 98.41 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.478 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -83.93 -22.96 31.35 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -179.435 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.634 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 8.6 tt -66.09 -20.54 27.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 120.84 0.353 . . . . 0.0 111.429 -179.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 80.1 p -70.47 -10.94 60.49 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.836 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -69.87 -26.33 64.14 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 0.0 110.917 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -68.28 127.54 33.32 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.531 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -159.48 52.26 0.38 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.98 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -146.95 152.97 39.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.593 0.196 . . . . 0.0 110.541 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 39.5 t -99.64 91.75 2.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.083 0.468 . . . . 0.0 110.538 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.449 ' HB3' HD12 ' A' ' 22' ' ' LEU . 91.6 mt -128.77 135.66 49.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.239 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 50.8 m -127.12 116.08 21.82 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.79 -0.186 . . . . 0.0 110.94 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -71.04 147.57 54.93 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.465 2.11 . . . . 0.0 112.123 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 59.9 m -131.11 144.19 51.22 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.773 0.321 . . . . 0.0 111.2 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -132.02 148.09 52.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.273 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -114.91 126.14 54.45 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.751 0.31 . . . . 0.0 110.444 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.2 m -127.16 145.76 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.517 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -68.33 -37.75 80.84 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.902 0.382 . . . . 0.0 110.985 179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -152.28 159.37 43.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.311 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 59.5 -106.13 0.27 Allowed 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.623 0.577 . . . . 0.0 111.377 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.15 -1.361 . . . . 0.0 112.273 -179.928 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.825 0.345 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 58.01 46.46 16.37 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.995 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -74.01 144.9 44.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.07 -173.39 41.7 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.275 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.8 t -107.32 125.39 51.12 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.695 0.283 . . . . 0.0 110.47 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 98.9 mtp -88.33 69.54 9.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.024 0.44 . . . . 0.0 111.009 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.27 149.37 32.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.373 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 82.32 4.86 90.03 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.625 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -71.1 143.87 50.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.806 0.336 . . . . 0.0 110.806 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.6 p -150.13 165.67 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.54 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -91.14 91.44 1.65 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.603 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -147.59 152.01 37.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.322 0.106 . . . . 0.0 110.773 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? 57.19 44.71 21.79 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 123.653 0.596 . . . . 0.0 111.812 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -93.71 4.22 72.12 Favored Glycine 0 CA--C 1.52 0.352 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.753 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -162.35 0.85 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.696 0.284 . . . . 0.0 110.999 -179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.67 159.74 29.41 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.822 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.6 p -73.48 110.0 7.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.897 0.38 . . . . 0.0 111.736 -179.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.19 -7.96 49.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.348 0.594 . . . . 0.0 110.476 178.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -106.89 21.23 17.86 Favored 'General case' 0 C--O 1.221 -0.418 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.356 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 t -70.37 114.14 8.2 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.41 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -163.7 175.03 10.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.6 178.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.1 mp -80.31 -57.87 3.4 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -71.51 -36.13 70.97 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.623 0.725 . . . . 0.0 110.589 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -112.42 69.76 0.7 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.334 178.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD13 ' CE1' ' A' ' 110' ' ' TYR . 83.8 mt -47.14 157.46 0.5 Allowed Pre-proline 0 N--CA 1.467 0.411 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.824 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -39.71 165.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 124.86 3.707 . . . . 0.0 114.182 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -49.85 -9.36 0.15 Allowed 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.932 3.088 . . . . 0.0 114.979 -178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.495 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.18 -35.29 67.06 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 117.773 0.26 . . . . 0.0 110.933 179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.887 HD23 ' HD2' ' A' ' 84' ' ' LYS . 8.1 tp -107.88 -77.8 0.59 Allowed 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 112.592 0.589 . . . . 0.0 112.592 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.53 -49.38 73.73 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.259 0.837 . . . . 0.0 113.259 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -51.79 56.85 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 -177.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.404 ' HG3' ' CB ' ' A' ' 106' ' ' LEU . 14.5 tm-20 -71.28 -43.49 67.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.496 HD13 HG21 ' A' ' 74' ' ' THR . 83.8 mt -67.86 -38.86 83.62 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -178.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.8 p -74.18 -32.1 62.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 120.143 -0.623 . . . . 0.0 111.822 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.96 -56.33 3.53 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 113.632 0.975 . . . . 0.0 113.632 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 69.3 t -64.43 -45.25 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 82.5 mt -72.8 -17.9 61.53 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 120.626 -0.43 . . . . 0.0 111.056 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.513 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.0 t70 -59.22 -37.79 78.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.979 0.419 . . . . 0.0 110.892 179.083 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.6 m -86.98 6.51 31.89 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.193 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.14 142.03 58.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.206 0.527 . . . . 0.0 111.458 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -131.42 46.19 2.69 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.155 -179.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.12 -11.79 71.2 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.637 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.16 -43.32 98.6 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.099 0.476 . . . . 0.0 111.059 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -114.67 -24.89 8.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.296 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.76 113.96 0.26 Allowed Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.222 -178.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 5.5 p90 -53.03 -46.01 68.24 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 117.429 0.614 . . . . 0.0 110.388 178.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 45.3 ptt85 -84.01 1.3 44.46 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.012 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.77 -50.87 60.54 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.54 -0.838 . . . . 0.0 113.952 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.436 HD13 HD11 ' A' ' 91' ' ' LEU . 96.5 mt -71.86 -41.87 67.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 117.281 0.54 . . . . 0.0 111.302 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.437 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.16 -41.52 94.6 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.1 tt0 -59.92 -44.11 94.51 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.19 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.039 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.468 HD22 HD21 ' A' ' 77' ' ' LEU . 1.3 tt -69.25 -43.83 73.17 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.94 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 39.4 t -155.87 139.73 16.23 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-O 120.752 0.31 . . . . 0.0 110.659 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.6 m -122.16 129.77 52.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.86 0.362 . . . . 0.0 111.272 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -157.29 141.95 16.67 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.899 179.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 48.8 m0 -64.49 -40.41 95.61 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.899 0.38 . . . . 0.0 111.333 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 89.4 mt -68.26 -39.57 82.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.055 179.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.426 ' O ' HG13 ' A' ' 63' ' ' ILE . 37.1 t70 -63.77 -45.97 87.37 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.568 -179.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.824 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.5 m -68.06 -26.59 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -178.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -63.86 -44.12 94.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.886 0.374 . . . . 0.0 110.59 178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -73.55 -24.95 60.18 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.287 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.824 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.6 mt -59.19 -40.27 80.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-O 121.198 0.523 . . . . 0.0 110.678 179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -69.77 -20.67 63.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.571 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.91 -52.49 8.77 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.496 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 3.7 mt-10 -86.48 -3.38 59.0 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.594 0.591 . . . . 0.0 112.594 -177.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 8.2 p -55.52 -34.81 35.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 CA-C-N 117.947 0.34 . . . . 0.0 111.134 179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -89.14 -4.59 58.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.82 0.343 . . . . 0.0 110.774 178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -105.12 21.94 16.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.614 -178.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.614 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.5 22.79 8.33 Favored Glycine 0 CA--C 1.521 0.456 0 C-N-CA 120.414 -0.898 . . . . 0.0 114.223 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.614 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.1 tppm? 93.93 139.05 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.389 1.076 . . . . 0.0 112.17 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.555 ' HB3' ' O ' ' A' ' 63' ' ' ILE . 4.1 t -131.4 -20.79 2.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.696 178.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.405 ' H ' ' HD3' ' A' ' 71' ' ' LYS . . . -60.65 -67.57 2.07 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.832 -1.175 . . . . 0.0 111.669 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.496 HG21 HD13 ' A' ' 33' ' ' LEU . 10.7 m -87.78 -35.03 18.09 Favored 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 122.612 -0.346 . . . . 0.0 111.573 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 78.2 ttt180 -60.86 -47.76 84.89 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.496 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.524 ' HB3' ' O ' ' A' ' 72' ' ' SER . 85.9 tt0 -62.5 -40.51 96.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.689 0.281 . . . . 0.0 110.908 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.468 HD21 HD22 ' A' ' 53' ' ' LEU . 63.3 tp -62.0 -47.15 86.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.834 179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.556 HD22 ' HG3' ' A' ' 84' ' ' LYS . 95.2 mt -71.05 -39.85 72.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.056 0.455 . . . . 0.0 111.483 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 26.2 t-105 -77.83 -6.89 55.66 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.368 -179.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.7 t -58.59 -42.16 87.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 60.1 m95 -85.63 -89.09 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.641 -0.423 . . . . 0.0 111.08 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -106.93 -86.59 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.176 0.512 . . . . 0.0 109.725 178.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -113.98 -56.15 2.43 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 177.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.887 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.7 ttpp -131.92 -43.97 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.005 175.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.3 t30 48.09 31.48 2.52 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.099 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.453 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.1 OUTLIER -139.27 169.51 17.64 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -179.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 78.4 p -127.28 160.07 32.45 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.804 0.335 . . . . 0.0 110.801 179.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.757 HG23 HD11 ' A' ' 107' ' ' ILE . 4.4 mm -59.44 -38.64 76.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.151 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -59.98 -40.18 96.61 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.628 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -66.42 -43.84 84.6 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.819 0.343 . . . . 0.0 111.09 179.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.751 ' HG ' HD11 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -74.5 -29.1 61.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.42 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.3 tp -58.05 -41.03 82.44 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 -178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -61.05 -43.19 99.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.976 0.417 . . . . 0.0 110.616 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 84.6 t -70.87 -41.17 77.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.527 0.68 . . . . 0.0 110.227 178.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 100' ' ' HIS . 61.0 tp -60.82 -40.95 94.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.06 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -60.95 -39.56 89.97 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.951 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.1 tp10 -64.5 -43.29 94.59 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.564 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 54.0 tpp -69.25 -39.99 78.14 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.182 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 77.48 40.31 23.52 Favored Glycine 0 CA--C 1.523 0.581 0 C-N-CA 120.792 -0.718 . . . . 0.0 114.687 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.401 ' HB3' HD11 ' A' ' 95' ' ' LEU . 9.4 t60 -80.92 112.83 18.67 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 117.631 0.715 . . . . 0.0 110.227 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.9 mmm180 -64.06 -42.44 97.01 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.7 tpt180 -62.23 -39.67 93.58 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.1 -178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.46 84.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.528 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.584 ' O ' HG22 ' A' ' 107' ' ' ILE . 96.4 mt -61.32 -43.16 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.455 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.476 ' O ' HG22 ' A' ' 108' ' ' THR . 85.6 m-70 -64.84 -39.46 93.6 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.86 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.433 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.0 OUTLIER -82.85 -30.42 28.67 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -179.529 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.757 HD11 HG23 ' A' ' 88' ' ' ILE . 13.6 tt -62.54 -22.67 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 105' ' ' HIS . 6.0 t -68.77 -6.73 28.33 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -89.02 3.2 52.49 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.831 0.348 . . . . 0.0 111.457 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.582 ' CE1' HD13 ' A' ' 25' ' ' LEU . 79.2 t80 -95.14 120.7 35.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.335 -0.393 . . . . 0.0 109.989 179.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -134.23 32.11 2.69 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.44 -0.886 . . . . 0.0 113.279 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -95.88 133.02 40.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.962 0.381 . . . . 0.0 111.101 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 21.9 m -100.95 3.74 10.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.957 0.408 . . . . 0.0 111.493 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 89.6 mt -112.45 144.2 42.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.668 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.4 m -122.59 86.86 49.25 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.738 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -81.58 64.92 8.68 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.83 2.353 . . . . 0.0 113.211 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 65.1 m -101.01 137.46 39.35 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.024 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -127.29 155.08 44.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.348 . . . . 0.0 111.258 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 26.2 pttm -143.39 157.41 44.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.096 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.5 m -130.03 149.65 51.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.926 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 92.9 t80 -120.04 127.97 53.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.199 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -124.79 144.64 50.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.34 -39.3 93.62 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.451 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 CA-C-O 118.498 -1.168 . . . . 0.0 112.086 179.97 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.459 0 CA-C-O 121.102 0.477 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -106.6 126.69 52.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.303 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 -126.94 150.35 49.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.559 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.29 -176.81 38.97 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.026 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.4 m 72.51 -57.09 0.64 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 123.341 0.656 . . . . 0.0 111.959 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.1 mtp 55.52 51.37 12.86 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.981 0.419 . . . . 0.0 111.568 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -135.41 153.01 51.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.917 -179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -176.0 -174.13 42.27 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.181 -0.533 . . . . 0.0 111.961 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -137.84 145.52 42.35 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.75 0.275 . . . . 0.0 111.039 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.6 t -69.04 129.75 40.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -127.42 162.54 21.39 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.429 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.44 154.69 42.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.558 0.218 . . . . 0.0 110.587 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.6 tpm_? -120.27 130.36 54.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.892 -179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.11 158.14 39.9 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.91 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.43 -39.92 95.77 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.826 0.346 . . . . 0.0 111.908 179.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.7 mt -95.24 145.35 25.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.515 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.6 p -79.63 108.44 13.18 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.962 0.41 . . . . 0.0 111.409 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.73 -11.81 32.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.447 0.641 . . . . 0.0 110.972 178.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -105.34 21.7 16.71 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.481 -178.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.3 t -81.9 119.27 23.72 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.47 172.02 19.09 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.4 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.6 tp -63.22 -50.34 70.63 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -178.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -91.48 -35.5 14.29 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.449 0.642 . . . . 0.0 110.904 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.79 71.0 1.04 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.082 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.449 HD13 ' CE1' ' A' ' 110' ' ' TYR . 93.6 mt -47.57 156.33 0.67 Allowed Pre-proline 0 CA--C 1.536 0.436 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.717 -179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -39.33 165.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.177 0 C-N-CA 125.068 3.846 . . . . 0.0 114.716 -179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -48.26 -8.78 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 124.296 3.331 . . . . 0.0 115.347 -178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.29 -36.4 66.12 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.118 0.417 . . . . 0.0 110.456 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.917 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.3 tp -107.76 -77.93 0.59 Allowed 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.76 -52.55 65.0 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -178.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.76 -49.45 78.41 Favored Glycine 0 CA--C 1.522 0.526 0 C-N-CA 120.684 -0.77 . . . . 0.0 114.683 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -70.94 -44.22 66.57 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD13 HG21 ' A' ' 74' ' ' THR . 95.7 mt -68.47 -38.89 81.48 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.649 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -74.08 -32.13 63.13 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.889 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.91 -55.25 4.05 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 66.3 t -64.51 -45.21 96.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.74 HD11 HD12 ' A' ' 49' ' ' LEU . 88.6 mt -72.75 -19.18 61.42 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.926 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.649 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 42.9 t0 -60.31 -36.12 77.19 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 57.0 m -86.11 5.76 32.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.183 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.46 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 51.4 t -65.36 142.19 58.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.399 0.619 . . . . 0.0 111.926 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -130.88 40.32 3.49 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.287 -0.869 . . . . 0.0 109.582 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 96.12 -15.46 62.92 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.023 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -43.18 97.19 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.931 0.365 . . . . 0.0 111.749 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.535 ' HG ' ' NE2' ' A' ' 100' ' ' HIS . 1.0 OUTLIER -108.47 -22.99 12.06 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.173 0.511 . . . . 0.0 109.997 179.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.46 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 76.95 107.61 0.15 Allowed Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.399 -0.818 . . . . 0.0 112.25 -178.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.2 p90 -52.71 -48.47 66.59 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 117.312 0.556 . . . . 0.0 110.31 178.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -84.17 0.01 50.35 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.599 177.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.44 -41.76 95.45 Favored Glycine 0 C--N 1.329 0.164 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.45 -177.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.74 HD12 HD11 ' A' ' 37' ' ' LEU . 92.7 mt -84.05 -43.02 15.52 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 117.04 0.42 . . . . 0.0 111.186 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.27 -40.96 94.6 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 113.591 0.959 . . . . 0.0 113.591 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.7 tp10 -60.58 -43.7 97.05 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 123.147 0.279 . . . . 0.0 111.302 -178.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.6 mtt85 -65.39 -39.37 92.14 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.588 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.717 HD22 HD21 ' A' ' 77' ' ' LEU . 1.4 tt -69.34 -45.66 68.92 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.762 0.315 . . . . 0.0 110.979 179.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.1 m -142.45 132.55 24.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.013 179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.6 m -114.84 122.4 46.24 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.9 m -136.68 148.75 47.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.092 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.475 ' CD1' ' HG ' ' A' ' 58' ' ' LEU . 69.2 t-105 -95.48 140.0 30.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.535 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.475 ' HG ' ' CD1' ' A' ' 57' ' ' TRP . 81.5 mt 75.99 -30.1 0.19 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.718 0.807 . . . . 0.0 112.361 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -66.58 -21.19 66.14 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.706 0.289 . . . . 0.0 111.235 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.493 ' HA ' HD12 ' A' ' 63' ' ' ILE . 25.4 m -63.07 -20.18 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.777 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -63.13 -41.21 99.27 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.616 179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 25.9 t60 -66.65 -26.7 67.18 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.917 179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.533 ' O ' ' HB3' ' A' ' 72' ' ' SER . 80.6 mt -59.53 -41.87 86.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 121.342 0.592 . . . . 0.0 109.914 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.492 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.1 mt-10 -69.38 -34.79 75.08 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.42 178.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -62.12 -47.7 83.44 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.596 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 61.8 mm-40 -89.36 -3.38 58.48 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.2 p -55.77 -33.59 34.57 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 CA-C-N 118.294 0.497 . . . . 0.0 111.268 -179.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.61 -4.61 57.74 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.899 0.38 . . . . 0.0 110.721 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -108.53 22.82 15.41 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.196 -178.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.636 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.74 16.04 18.65 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.169 -1.015 . . . . 0.0 114.734 179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.636 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 97.83 143.73 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.491 1.116 . . . . 0.0 111.975 177.26 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 66' ' ' GLU . 1.2 t -132.09 -27.81 1.79 Allowed 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.495 178.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -54.33 -67.34 2.22 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 119.962 -1.113 . . . . 0.0 112.204 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.463 HG21 HD13 ' A' ' 33' ' ' LEU . 21.8 m -87.24 -35.96 18.21 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.774 -0.251 . . . . 0.0 111.535 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.4 ttt-85 -60.57 -46.73 89.14 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.874 -178.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.52 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.4 tt0 -62.08 -42.81 99.59 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.476 0.179 . . . . 0.0 110.909 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.717 HD21 HD22 ' A' ' 53' ' ' LEU . 64.3 tp -61.57 -46.42 89.97 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.463 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.642 HD22 ' HG3' ' A' ' 84' ' ' LYS . 98.3 mt -67.33 -39.54 85.83 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.486 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -80.26 -5.54 56.39 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 63.5 m -59.07 -40.01 83.87 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 96.8 m95 -86.4 -90.61 0.11 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 120.59 -0.444 . . . . 0.0 111.18 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.33 -87.28 0.5 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.182 0.515 . . . . 0.0 109.717 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 21.0 mp0 -110.47 -56.91 2.28 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.917 ' HD2' HD23 ' A' ' 29' ' ' LEU . 17.4 ttpp -132.5 -43.36 0.93 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.206 176.446 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 48.51 34.32 4.78 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.891 0.876 . . . . 0.0 111.883 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.489 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.22 169.3 18.03 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 60.2 p -125.28 158.62 33.69 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.717 179.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 mp -59.87 -40.06 81.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.792 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -61.5 -40.17 98.32 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.733 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -64.27 -40.79 96.7 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.634 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.74 -24.35 36.13 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.259 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.2 tp -59.16 -40.1 84.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.113 -179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -61.7 -41.35 97.48 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.906 0.384 . . . . 0.0 110.482 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 87.2 t -69.32 -41.17 80.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-O 121.282 0.563 . . . . 0.0 110.022 178.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.497 HD13 ' O ' ' A' ' 91' ' ' LEU . 6.6 mp -59.06 -36.85 75.74 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.704 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -62.84 -39.35 94.12 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.353 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.7 tp10 -61.9 -47.37 85.27 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.65 0.262 . . . . 0.0 110.657 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 90.2 mmm -71.21 -36.22 71.79 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 178.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 79.36 33.06 36.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.533 -0.841 . . . . 0.0 112.331 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.535 ' NE2' ' HG ' ' A' ' 44' ' ' LEU . 32.9 t-80 -66.8 108.25 2.46 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.871 0.367 . . . . 0.0 110.524 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -63.75 -44.74 92.57 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 32.6 tpt180 -64.39 -41.4 96.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.006 0.432 . . . . 0.0 111.044 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.518 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.91 -40.3 92.61 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.668 -0.697 . . . . 0.0 110.806 -179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.6 ' O ' HG22 ' A' ' 107' ' ' ILE . 95.9 mt -62.72 -45.1 99.67 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.99 179.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -65.96 -40.54 91.38 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -83.03 -22.37 33.59 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -179.013 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.6 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.9 tp -66.41 -20.79 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 120.753 0.311 . . . . 0.0 111.161 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 64.3 p -70.5 -10.25 58.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.934 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -69.92 -26.24 64.05 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.871 0.367 . . . . 0.0 110.865 179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.449 ' CE1' HD13 ' A' ' 25' ' ' LEU . 82.1 t80 -70.78 129.22 38.53 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.266 179.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -72.2 146.06 38.78 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.192 -179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.434 ' O ' ' HB ' ' A' ' 113' ' ' VAL . . . -95.01 156.48 16.3 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.021 -0.105 . . . . 0.0 110.973 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.454 HG12 ' HG ' ' A' ' 114' ' ' LEU . 88.5 t 76.42 139.0 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 O-C-N 123.887 0.742 . . . . 0.0 111.116 -179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.454 ' HG ' HG12 ' A' ' 113' ' ' VAL . 87.5 mt 64.38 39.98 6.74 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.208 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.7 m -72.06 133.35 83.83 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.894 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.64 61.54 6.17 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.788 2.325 . . . . 0.0 113.163 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 97.1 p -82.97 -11.28 58.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.739 179.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 78.8 mm-40 -128.33 156.34 43.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.333 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -65.79 -20.48 66.27 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.595 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 68.6 m -61.49 -38.11 86.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.337 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 -71.89 141.11 49.54 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 24.0 pt20 -150.02 160.16 43.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 59.94 -111.17 0.5 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.662 0.601 . . . . 0.0 111.253 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.149 -1.362 . . . . 0.0 112.195 -179.952 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 120.912 0.387 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 99.5 mt-10 -118.55 134.27 55.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.577 179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 62.6 t80 -63.59 -45.89 88.32 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.978 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 166.22 38.0 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.956 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.5 ' HA ' HH11 ' A' ' 101' ' ' ARG . 62.3 m -132.74 103.95 6.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.602 0.239 . . . . 0.0 110.958 179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.4 mmt -134.56 152.86 52.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.772 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.53 136.56 54.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.748 179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 177.55 -179.49 48.19 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.01 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -133.81 103.92 6.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.816 0.341 . . . . 0.0 110.923 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 74.0 m -130.93 157.83 41.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.347 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -123.72 143.85 15.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.404 -0.903 . . . . 0.0 112.807 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.4 148.34 43.43 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.501 0.191 . . . . 0.0 111.16 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.418 ' H ' ' HG3' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -70.88 -24.91 62.58 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -179.57 178.1 48.5 Favored Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.461 -0.876 . . . . 0.0 112.88 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -98.38 -36.69 9.89 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.4 mt -102.68 138.99 38.85 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.431 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 2.8 p -80.82 108.64 14.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.237 0.541 . . . . 0.0 112.229 -178.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.16 -9.82 41.05 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.884 178.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -102.77 21.72 14.99 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.889 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -72.1 121.0 18.51 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -168.19 160.35 11.61 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 114' ' ' LEU . 65.0 tp -65.85 -51.03 62.3 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -76.09 -36.73 58.82 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.457 0.646 . . . . 0.0 111.242 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -113.88 70.9 0.73 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.836 178.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.628 HD22 ' HE1' ' A' ' 110' ' ' TYR . 91.6 mt -45.43 154.43 0.51 Allowed Pre-proline 0 CA--C 1.538 0.504 0 O-C-N 123.869 0.731 . . . . 0.0 111.848 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -38.04 163.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.361 1.199 0 C-N-CA 125.12 3.88 . . . . 0.0 115.075 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.431 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 85.1 Cg_exo -48.76 -9.41 0.09 OUTLIER 'Trans proline' 0 C--N 1.36 1.153 0 C-N-CA 124.415 3.41 . . . . 0.0 115.177 -178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.777 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -53.86 -35.29 61.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.784 0.265 . . . . 0.0 110.5 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.83 HD23 ' HD2' ' A' ' 84' ' ' LYS . 3.0 tp -108.03 -77.3 0.6 Allowed 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.197 0.444 . . . . 0.0 112.197 178.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -53.98 51.54 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.68 -51.75 57.12 Favored Glycine 0 CA--C 1.525 0.699 0 C-N-CA 120.63 -0.795 . . . . 0.0 115.045 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.5 ' OE1' ' HG ' ' A' ' 106' ' ' LEU . 35.8 tp10 -71.3 -43.06 67.82 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.44 -39.32 85.38 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.631 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 16.4 p -71.46 -29.2 64.58 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.474 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.55 -55.8 3.82 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.406 HG21 ' HG2' ' A' ' 102' ' ' ARG . 54.8 t -64.14 -44.93 97.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -178.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.527 ' HB2' ' CE ' ' A' ' 71' ' ' LYS . 88.6 mt -77.56 -16.8 58.42 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 122.068 -0.395 . . . . 0.0 111.846 -179.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.631 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 32.5 t70 -59.34 -39.59 83.65 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.134 0.493 . . . . 0.0 110.556 178.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -93.27 11.42 28.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.003 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 23.9 t -67.86 144.68 55.19 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 121.015 0.436 . . . . 0.0 111.199 -179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -136.59 54.89 1.86 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.92 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.07 -12.94 68.85 Favored Glycine 0 CA--C 1.519 0.284 0 C-N-CA 121.035 -0.602 . . . . 0.0 114.095 178.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.42 -42.99 98.75 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 117.564 0.682 . . . . 0.0 110.894 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 85.3 mt -125.38 -30.63 3.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.569 178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 84.5 117.3 0.74 Allowed Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.237 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.451 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 27.6 p90 -56.24 -42.81 77.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 117.043 0.421 . . . . 0.0 110.743 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.604 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -84.27 -0.35 52.01 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.671 178.193 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.87 -45.65 94.72 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.548 -0.834 . . . . 0.0 113.235 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 85.5 mt -72.21 -43.32 64.63 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.887 0.343 . . . . 0.0 111.262 179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.772 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -65.4 -41.64 93.45 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 54.8 tp10 -61.71 -43.79 98.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.305 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -65.09 -40.33 94.43 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.715 ' O ' ' HB2' ' A' ' 54' ' ' SER . 59.7 tp -66.81 -47.13 72.99 Favored 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.447 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.715 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 0.1 OUTLIER 149.22 93.34 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 O-C-N 124.452 1.095 . . . . 0.0 110.714 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.0 p -84.37 -12.57 54.28 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.816 0.341 . . . . 0.0 110.98 179.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 49.8 m 61.19 16.14 6.97 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.507 -0.77 . . . . 0.0 112.155 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 17.2 m-90 53.73 24.78 4.56 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.12 0.568 . . . . 0.0 112.335 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 58.4 tp -128.57 -42.67 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.122 0.487 . . . . 0.0 110.476 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -65.93 -20.45 66.22 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.615 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.829 ' HA ' HD12 ' A' ' 63' ' ' ILE . 16.4 m -58.26 -31.1 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -63.57 -40.85 98.02 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.927 0.394 . . . . 0.0 110.329 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -76.29 -24.07 54.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.719 179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.829 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.0 mt -59.85 -43.6 92.33 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.124 0.488 . . . . 0.0 110.294 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.521 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.7 mt-10 -67.39 -36.24 80.9 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.931 178.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.85 -49.06 76.38 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.547 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 5.9 mt-10 -90.08 -4.17 57.51 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 113.418 0.896 . . . . 0.0 113.418 -178.408 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.521 HG12 ' O ' ' A' ' 64' ' ' GLU . 5.2 p -56.44 -33.71 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.364 0.529 . . . . 0.0 111.226 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.38 -4.25 58.12 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 110.803 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -106.97 22.13 16.47 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.026 -178.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.665 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.41 20.94 9.7 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.275 -0.964 . . . . 0.0 114.124 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.665 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 1.2 tppp? 95.72 147.79 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.447 1.099 . . . . 0.0 112.082 177.369 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.547 ' HB2' ' HB2' ' A' ' 66' ' ' GLU . 3.5 t -138.29 -30.91 0.77 Allowed 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.54 178.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -52.88 -66.95 2.36 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.279 -0.963 . . . . 0.0 112.708 -179.738 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 5.3 m -87.8 -34.45 18.28 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 122.441 -0.447 . . . . 0.0 111.113 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -60.9 -48.37 82.12 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.812 -178.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' SER . 83.0 tt0 -63.15 -41.19 99.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.641 0.258 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.772 HD22 ' HA ' ' A' ' 50' ' ' ALA . 62.2 tp -60.89 -47.23 87.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.781 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 97.6 mt -70.34 -38.51 74.85 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.113 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.9 t-105 -76.64 -6.62 52.83 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -178.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 64.6 m -58.87 -40.29 83.92 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.741 0.645 . . . . 0.0 112.741 -178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -86.5 -90.19 0.11 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.562 -0.455 . . . . 0.0 110.786 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.26 -86.8 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -112.41 -55.98 2.45 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.83 ' HD2' HD23 ' A' ' 29' ' ' LEU . 1.2 ttpm? -132.31 -43.75 0.94 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 176.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.1 t30 47.76 36.02 5.3 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.752 0.821 . . . . 0.0 111.269 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.0 170.85 15.23 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.802 -178.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 67.5 p -117.99 155.38 30.37 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.037 178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.14 -39.3 78.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.529 -0.759 . . . . 0.0 110.873 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -63.8 -39.02 97.0 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 121.151 -0.547 . . . . 0.0 113.027 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -62.26 -46.63 87.95 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.604 ' HB3' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -75.98 -23.88 55.35 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.757 -0.201 . . . . 0.0 111.178 -179.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.21 -39.46 82.72 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.027 -179.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.432 ' O ' ' HG2' ' A' ' 96' ' ' GLN . 53.3 mt-30 -61.22 -42.16 98.12 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.04 0.448 . . . . 0.0 110.47 179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 99.7 t -71.75 -40.15 69.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.391 178.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 86.2 mt -61.64 -41.08 97.01 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.209 -179.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 93' ' ' GLN . 16.6 pt20 -68.67 -28.14 66.61 Favored 'General case' 0 C--O 1.232 0.154 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.0 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 53.9 tp10 -64.41 -48.83 73.89 Favored 'General case' 0 CA--C 1.528 0.118 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 88.7 mmm -71.76 -36.72 70.47 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.437 178.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 98.48 40.41 3.43 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.947 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -73.87 88.57 1.82 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.987 0.422 . . . . 0.0 111.578 -179.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.5 HH11 ' HA ' ' A' ' 5' ' ' SER . 19.4 mmt85 -62.76 -43.25 99.28 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.213 0.819 . . . . 0.0 113.213 179.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.406 ' HG2' HG21 ' A' ' 36' ' ' VAL . 7.3 tpm_? -63.22 -40.01 96.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.819 0.342 . . . . 0.0 111.106 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.498 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.78 -38.27 87.42 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.602 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.591 ' O ' HG22 ' A' ' 107' ' ' ILE . 94.6 mt -61.39 -44.29 98.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.579 179.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -65.08 -40.78 95.13 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.581 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.5 ' HG ' ' OE1' ' A' ' 32' ' ' GLU . 0.2 OUTLIER -81.07 -22.39 39.26 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.502 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.777 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 1.5 tp -63.18 -20.97 27.11 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.863 0.363 . . . . 0.0 111.08 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.8 p -73.02 -13.18 61.17 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.621 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -74.33 -10.03 59.18 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.628 ' HE1' HD22 ' A' ' 25' ' ' LEU . 87.9 t80 -63.12 129.26 39.56 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.89 135.21 15.71 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.932 -179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -85.69 -3.29 58.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.689 0.28 . . . . 0.0 111.532 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 72.2 t -62.09 -45.56 98.46 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.903 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 22' ' ' LEU . 61.9 tp -123.49 114.16 19.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.314 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 49.0 m -131.52 125.3 20.57 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.025 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.31 156.76 54.55 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.639 2.226 . . . . 0.0 111.812 178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.6 m -64.15 116.87 6.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.879 0.371 . . . . 0.0 110.89 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -136.6 155.59 49.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.73 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 1.6 mptp? -95.27 167.4 11.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.99 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 62.6 m -67.18 128.58 36.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.253 . . . . 0.0 110.576 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -111.61 7.95 20.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.728 0.299 . . . . 0.0 111.345 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -128.71 149.96 50.47 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.688 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.7 -39.4 93.6 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.152 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.531 -1.149 . . . . 0.0 112.227 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 CA-C-O 120.59 0.233 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 57.21 43.72 23.34 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.372 179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -99.14 141.5 31.82 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.073 179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.47 ' HA3' ' HE1' ' A' ' 46' ' ' TRP . . . 177.24 -176.47 48.07 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.322 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.484 ' HB2' HG11 ' A' ' 67' ' ' VAL . 52.7 m -124.61 147.17 48.66 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 99.0 mtp -87.26 71.61 10.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.21 -179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.71 153.89 33.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 150.43 144.1 3.86 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.407 179.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -152.5 113.88 4.27 Favored 'General case' 0 N--CA 1.462 0.157 0 O-C-N 122.868 -0.195 . . . . 0.0 110.747 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 11.0 t -156.99 151.0 24.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.394 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -72.32 162.06 54.47 Favored Glycine 0 CA--C 1.521 0.441 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.52 -3.89 59.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 66.39 -121.4 0.3 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.679 0.392 . . . . 0.0 111.194 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.49 8.34 77.59 Favored Glycine 0 C--N 1.335 0.497 0 C-N-CA 120.722 -0.751 . . . . 0.0 113.004 -179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -103.09 -164.23 1.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.621 0.248 . . . . 0.0 111.186 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.1 tp -61.85 135.81 57.73 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.224 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 p -71.09 106.83 3.87 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.235 0.541 . . . . 0.0 112.141 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.31 -9.8 37.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.712 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -99.86 21.5 12.49 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.178 -178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.457 HG23 ' HD3' ' A' ' 26' ' ' PRO . 21.5 m -78.68 113.38 16.68 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.638 -0.425 . . . . 0.0 111.387 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' THR . 26.8 mt -154.8 170.61 21.23 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.76 179.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.3 tp -63.24 -50.46 70.11 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -92.01 -35.99 13.65 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.09 0.471 . . . . 0.0 111.583 -178.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -105.65 70.78 0.88 Allowed 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 96.1 mt -45.09 158.84 0.28 Allowed Pre-proline 0 N--CA 1.468 0.461 0 CA-C-N 115.144 -0.935 . . . . 0.0 111.923 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' HD3' HG23 ' A' ' 20' ' ' THR . 2.4 Cg_endo -39.96 165.65 0.02 OUTLIER 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 124.67 3.58 . . . . 0.0 114.546 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -48.88 -8.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.038 3.159 . . . . 0.0 114.919 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.564 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.49 -36.82 67.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 117.867 0.303 . . . . 0.0 110.273 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.963 HD23 ' HD2' ' A' ' 84' ' ' LYS . 6.1 tp -107.8 -78.27 0.59 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 tt -60.32 -48.54 81.29 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.345 0.868 . . . . 0.0 113.345 -177.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -61.96 -51.09 59.47 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.331 -0.938 . . . . 0.0 114.436 -178.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -71.05 -43.3 68.1 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.848 0.685 . . . . 0.0 112.848 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 95.3 mt -67.36 -37.95 84.03 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.2 p -75.0 -31.97 61.54 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 120.172 -0.611 . . . . 0.0 111.652 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.51 -58.46 2.66 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.32 -44.8 99.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.467 HD21 ' CD2' ' A' ' 100' ' ' HIS . 76.1 mt -71.91 -19.55 61.91 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.528 -178.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HA ' ' NZ ' ' A' ' 71' ' ' LYS . 28.2 t0 -61.7 -38.28 87.28 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.123 0.487 . . . . 0.0 110.591 179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.3 p -87.35 1.68 52.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.012 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 45.9 t -66.89 142.55 57.27 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.267 0.556 . . . . 0.0 111.634 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -131.51 50.07 2.26 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.468 -179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.8 -12.78 68.78 Favored Glycine 0 CA--C 1.521 0.442 0 CA-C-N 115.821 -0.627 . . . . 0.0 113.65 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.44 98.68 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.159 0.504 . . . . 0.0 111.097 179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 84.1 mt -116.16 -29.41 6.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.582 -0.735 . . . . 0.0 109.51 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.81 107.9 0.55 Allowed Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.241 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.547 ' CD1' ' HG3' ' A' ' 47' ' ' ARG . 33.1 p90 -53.81 -44.99 70.66 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.988 0.394 . . . . 0.0 110.671 178.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.625 ' HB3' HD13 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -85.31 -0.51 54.98 Favored 'General case' 0 C--O 1.219 -0.541 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 178.277 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.98 -47.36 91.1 Favored Glycine 0 C--N 1.329 0.166 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.076 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.465 HD12 HG21 ' A' ' 74' ' ' THR . 88.8 mt -72.55 -42.13 65.0 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.858 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.603 ' HB2' ' O ' ' A' ' 73' ' ' GLY . . . -63.31 -42.54 99.03 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.12 -42.04 99.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.092 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.94 -42.01 77.28 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.98 179.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 78.7 mt -65.62 -40.34 92.47 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.135 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 t 66.17 114.18 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.903 0.752 . . . . 0.0 112.533 178.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.465 ' OG ' ' HB2' ' A' ' 59' ' ' ASP . 96.0 p -91.42 -3.58 56.52 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.194 179.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 56.5 m 59.05 38.01 24.15 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.342 -179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -159.52 -177.9 6.74 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.773 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 87.6 mt -78.08 62.92 2.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.116 0.484 . . . . 0.0 110.607 179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.465 ' HB2' ' OG ' ' A' ' 55' ' ' SER . 31.8 t0 -63.07 -38.15 90.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.733 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.781 ' HA ' HD12 ' A' ' 63' ' ' ILE . 29.6 m -59.72 -25.56 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.222 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -62.79 -44.52 95.95 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.153 0.502 . . . . 0.0 109.777 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -80.16 -23.85 40.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.283 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.781 HD12 ' HA ' ' A' ' 60' ' ' VAL . 80.3 mt -57.96 -44.57 87.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-O 120.616 0.246 . . . . 0.0 111.019 -178.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.527 ' O ' HG12 ' A' ' 67' ' ' VAL . 99.0 mt-10 -67.36 -37.34 83.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.132 0.491 . . . . 0.0 110.838 178.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -64.42 -50.27 68.23 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 115.435 1.643 . . . . 0.0 115.435 -178.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.593 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 52.5 mm-40 -89.75 -5.34 57.07 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.527 HG12 ' O ' ' A' ' 64' ' ' GLU . 8.5 p -57.93 -32.79 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-N 118.266 0.485 . . . . 0.0 111.065 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -88.8 -4.93 58.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.866 0.365 . . . . 0.0 110.516 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.6 mm100 -104.78 21.41 16.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.781 -178.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 103.8 11.18 33.28 Favored Glycine 0 CA--C 1.523 0.55 0 CA-C-O 118.407 -1.218 . . . . 0.0 114.976 179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.592 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.5 OUTLIER 112.17 141.74 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.047 1.339 . . . . 0.0 111.624 177.34 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.607 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 5.8 t -128.54 -35.7 1.92 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 114.981 -1.008 . . . . 0.0 110.797 178.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.603 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -49.43 -62.11 5.01 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.847 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.514 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -89.55 -43.06 11.06 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.531 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 75.8 ttt180 -61.77 -47.63 84.29 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.607 ' HB3' ' O ' ' A' ' 72' ' ' SER . 50.3 tp10 -61.88 -43.67 98.38 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 121.3 -0.16 . . . . 0.0 111.308 -178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.78 -44.12 94.32 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.599 HD22 ' HG3' ' A' ' 84' ' ' LYS . 96.3 mt -64.62 -39.67 94.13 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.928 0.394 . . . . 0.0 111.057 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -82.13 -6.36 59.13 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -179.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 62.7 m -59.77 -39.48 85.01 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -85.79 -90.67 0.1 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -108.39 -86.33 0.51 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.346 0.593 . . . . 0.0 110.018 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -113.25 -57.07 2.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.963 ' HD2' HD23 ' A' ' 29' ' ' LEU . 14.9 ttpp -132.12 -42.59 0.98 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 45.6 t30 49.1 33.62 5.01 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.652 178.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.519 ' H ' ' HG2' ' A' ' 84' ' ' LYS . 0.0 OUTLIER -139.65 167.8 21.28 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.5 p -127.23 158.86 36.03 Favored 'General case' 0 C--N 1.322 -0.592 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.67 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.19 -41.95 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.373 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.02 -40.21 98.6 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.72 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.24 -45.62 87.36 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.771 0.32 . . . . 0.0 111.762 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.617 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -76.1 -24.69 55.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.63 -179.653 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' A' ' 95' ' ' LEU . 61.7 tp -59.15 -41.36 88.13 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.349 -179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -62.39 -41.59 98.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.138 0.495 . . . . 0.0 110.427 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.405 HG12 ' CD2' ' A' ' 49' ' ' LEU . 85.5 t -70.42 -39.86 76.9 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.416 179.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 90.6 mt -61.13 -40.26 93.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.608 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -63.93 -40.34 96.23 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.942 179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -62.16 -48.03 81.88 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.38 179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 94.7 mmm -71.11 -37.64 72.36 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.8 40.07 2.99 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.206 -179.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.467 ' CD2' HD21 ' A' ' 37' ' ' LEU . 37.4 m80 -78.32 83.41 4.56 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -63.31 -41.46 98.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.144 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.3 tpp180 -63.53 -40.92 98.29 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 110.755 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.56 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.11 -39.23 89.2 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.484 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.596 ' O ' HG22 ' A' ' 107' ' ' ILE . 43.1 mm -62.58 -43.63 98.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.402 179.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -61.1 -48.2 82.76 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.788 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.1 mp -80.39 -21.26 42.47 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.275 0.843 . . . . 0.0 113.275 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.596 HG22 ' O ' ' A' ' 104' ' ' ILE . 1.1 tp -62.53 -21.23 26.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-O 120.871 0.367 . . . . 0.0 111.082 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 1.1 m -62.78 -14.46 45.38 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.772 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 50.8 m-80 -69.65 -26.26 64.31 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.551 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -71.95 127.54 32.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.748 0.309 . . . . 0.0 110.276 179.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -161.21 62.3 0.28 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.658 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -146.88 152.08 38.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.619 0.247 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 45.1 t -95.01 94.95 4.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 121.192 0.52 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 90.8 mt -131.92 157.12 44.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.8 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 48.9 m -128.91 68.42 79.41 Favored Pre-proline 0 CA--C 1.533 0.295 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.857 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -66.77 154.62 73.88 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.096 2.531 . . . . 0.0 112.1 178.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 57.5 m -61.92 142.91 57.14 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.491 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -124.14 135.33 53.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.679 0.276 . . . . 0.0 111.166 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -127.1 131.58 50.8 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.267 179.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 54.2 m -136.95 139.94 41.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.683 -0.235 . . . . 0.0 110.615 179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.7 -52.69 1.57 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.881 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . 0.489 ' HB3' ' H ' ' A' ' 123' ' ' GLU . 12.1 mp0 56.85 -152.61 0.39 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.26 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.489 ' H ' ' HB3' ' A' ' 122' ' ' GLN . 97.5 mt-10 -64.06 -38.9 92.75 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.931 0.396 . . . . 0.0 111.163 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.155 0 CA-C-O 118.36 -1.245 . . . . 0.0 112.141 179.934 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.991 0.424 . . . . 0.0 110.864 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -149.8 160.07 43.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.661 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -126.16 147.03 49.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.51 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -176.79 179.52 47.73 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 60.3 m -128.74 150.28 50.35 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.651 0.262 . . . . 0.0 110.639 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 65.9 mtt -115.59 140.63 48.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.508 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.48 -139.91 0.77 Allowed 'General case' 0 CA--C 1.532 0.265 0 O-C-N 123.648 0.593 . . . . 0.0 111.321 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 83.11 1.73 90.55 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.78 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -155.43 165.86 35.32 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.9 p -77.99 159.32 28.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.883 0.373 . . . . 0.0 110.988 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -93.02 -167.9 39.04 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.623 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.21 -39.47 92.88 Favored 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.458 0.17 . . . . 0.0 111.458 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 80.0 mtp180 58.72 40.19 23.48 Favored 'General case' 0 N--CA 1.468 0.451 0 O-C-N 123.531 0.519 . . . . 0.0 111.549 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -149.4 -133.06 2.15 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.18 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.91 -38.92 90.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.685 0.279 . . . . 0.0 111.622 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -98.51 138.82 35.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.017 0.437 . . . . 0.0 111.071 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.8 p -101.63 111.32 23.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.854 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.21 -8.72 52.99 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.036 0.446 . . . . 0.0 111.449 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -104.31 21.68 16.17 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.139 -179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.6 m -69.13 119.73 13.87 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -166.62 176.52 7.19 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.454 178.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -79.94 -58.03 3.36 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -179.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -72.66 -35.69 67.77 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.536 0.684 . . . . 0.0 110.813 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -112.25 70.56 0.72 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.902 -1.044 . . . . 0.0 109.849 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.479 HD22 ' HE1' ' A' ' 110' ' ' TYR . 98.5 mt -48.09 158.03 0.6 Allowed Pre-proline 0 CA--C 1.538 0.486 0 O-C-N 123.802 0.689 . . . . 0.0 111.589 -179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -38.77 165.76 0.01 OUTLIER 'Trans proline' 0 C--N 1.361 1.217 0 C-N-CA 124.987 3.792 . . . . 0.0 114.622 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -50.29 -9.34 0.17 Allowed 'Trans proline' 0 C--N 1.362 1.28 0 C-N-CA 123.874 3.049 . . . . 0.0 114.812 -178.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.558 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -56.19 -36.15 68.05 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.575 0.171 . . . . 0.0 110.546 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.937 HD23 ' HD2' ' A' ' 84' ' ' LYS . 4.4 tp -108.25 -78.93 0.58 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 120.17 -0.612 . . . . 0.0 112.562 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.34 -48.6 80.57 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -59.8 -52.35 53.5 Favored Glycine 0 CA--C 1.526 0.731 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.525 -177.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -72.37 -43.4 64.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.658 ' HB3' HG21 ' A' ' 74' ' ' THR . 96.0 mt -67.5 -38.55 84.49 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 -177.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 15.5 p -77.09 -33.0 57.07 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.101 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.57 -56.8 3.33 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.456 HG11 ' HG2' ' A' ' 102' ' ' ARG . 63.1 t -64.25 -45.07 97.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -177.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.628 HD13 HD11 ' A' ' 49' ' ' LEU . 53.0 mt -73.45 -17.62 61.22 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.152 -178.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.507 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 35.6 t70 -59.41 -37.09 77.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.986 0.422 . . . . 0.0 110.671 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.6 p -84.85 4.58 32.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.471 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.405 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 53.9 t -61.91 141.33 58.06 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-O 121.329 0.585 . . . . 0.0 112.005 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -132.36 45.94 2.7 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.89 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.86 -12.01 70.03 Favored Glycine 0 CA--C 1.52 0.377 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.282 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.67 98.67 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.997 0.427 . . . . 0.0 111.451 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -116.14 -23.49 8.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.018 178.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.405 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 79.73 109.86 0.25 Allowed Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.957 -178.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -53.06 -47.89 68.1 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.168 0.484 . . . . 0.0 110.532 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.526 ' HB3' HG21 ' A' ' 63' ' ' ILE . 39.9 ptt180 -83.34 2.3 36.94 Favored 'General case' 0 C--O 1.214 -0.77 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 178.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -56.02 -37.41 71.07 Favored Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.641 -0.79 . . . . 0.0 113.03 -177.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.628 HD11 HD13 ' A' ' 37' ' ' LEU . 0.2 OUTLIER -82.19 -45.22 15.38 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.65 0.262 . . . . 0.0 110.832 179.503 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -61.84 -38.07 86.85 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.717 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.78 -43.4 94.39 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.157 -178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.68 -39.23 93.8 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.187 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.574 HD22 HD11 ' A' ' 77' ' ' LEU . 4.4 tt -65.83 -37.85 87.34 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.8 m 64.3 68.28 0.56 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.873 -0.603 . . . . 0.0 112.327 178.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 53.6 m -66.4 154.64 39.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.8 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 m -67.61 151.99 46.38 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.861 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 97.4 m95 68.07 -161.59 0.21 Allowed 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.648 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.2 mp -99.19 72.07 1.84 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-O 121.07 0.462 . . . . 0.0 111.041 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -70.59 -19.26 62.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.307 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.796 ' HA ' HD12 ' A' ' 63' ' ' ILE . 15.8 m -61.22 -30.66 48.31 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 99.7 m-20 -63.5 -40.99 98.53 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.041 0.448 . . . . 0.0 110.211 178.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -74.39 -25.99 59.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.661 179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.796 HD12 ' HA ' ' A' ' 60' ' ' VAL . 83.1 mt -59.81 -43.71 92.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.368 0.604 . . . . 0.0 109.975 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.52 ' O ' HG12 ' A' ' 67' ' ' VAL . 98.8 mt-10 -67.85 -36.15 79.82 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.135 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -62.81 -49.07 76.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.514 ' HB2' ' HB2' ' A' ' 72' ' ' SER . 4.8 mt-10 -89.99 -4.04 57.66 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 -178.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.8 p -56.67 -33.9 41.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 118.239 0.472 . . . . 0.0 111.12 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -89.54 -4.24 57.98 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.847 0.356 . . . . 0.0 110.733 178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -106.15 21.99 16.44 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.015 -178.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.568 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.29 21.74 9.18 Favored Glycine 0 CA--C 1.52 0.396 0 C-N-CA 120.269 -0.967 . . . . 0.0 114.281 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.568 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 94.37 141.83 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.36 1.064 . . . . 0.0 112.175 177.342 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.553 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 3.3 t -132.31 -29.9 1.56 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.078 178.064 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.582 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -58.58 -54.15 40.15 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 119.865 -1.159 . . . . 0.0 112.269 -179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.658 HG21 ' HB3' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -91.5 -43.4 9.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.149 0.499 . . . . 0.0 111.872 178.688 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.534 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 77.4 ttt180 -60.13 -47.58 85.33 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.548 -177.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.553 ' HB3' ' O ' ' A' ' 72' ' ' SER . 82.7 tt0 -62.59 -41.13 98.77 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.782 0.325 . . . . 0.0 110.754 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.658 HD22 ' HA ' ' A' ' 50' ' ' ALA . 61.2 tp -61.19 -46.59 89.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.686 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.573 HD22 ' HG3' ' A' ' 84' ' ' LYS . 90.5 mt -71.61 -38.95 70.77 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.148 0.499 . . . . 0.0 111.014 179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 19.4 t-105 -75.32 -6.26 48.97 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 -178.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 67.2 m -58.24 -40.35 81.5 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -86.77 -89.96 0.12 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.792 179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.24 0.5 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -112.36 -55.79 2.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.937 ' HD2' HD23 ' A' ' 29' ' ' LEU . 20.3 ttpp -132.74 -44.58 0.89 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.604 175.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.3 t30 47.66 35.87 4.94 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.941 178.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.04 167.9 21.02 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 69.8 p -117.51 157.58 26.04 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.396 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.42 -39.44 79.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.431 -179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -62.81 -40.47 99.27 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 120.902 -0.665 . . . . 0.0 112.981 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -64.04 -40.84 97.21 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.624 ' CB ' HD11 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -81.79 -24.34 36.0 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.128 -179.715 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 61.7 tp -59.66 -41.94 91.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.889 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.14 -41.33 98.15 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.445 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -66.73 -41.85 88.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.216 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 91' ' ' LEU . 93.2 mt -61.62 -40.88 96.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.844 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -65.03 -39.59 93.57 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.527 179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 54.4 tp10 -61.81 -48.83 78.84 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.44 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 15.3 tpt -72.53 -39.82 67.23 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.694 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 105.8 40.35 2.02 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.987 -179.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.475 ' O ' HG12 ' A' ' 104' ' ' ILE . 77.4 m80 -78.38 87.68 4.4 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.718 0.294 . . . . 0.0 110.77 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 96.1 mtm-85 -62.64 -42.85 99.83 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.456 ' HG2' HG11 ' A' ' 36' ' ' VAL . 25.4 tpp180 -63.45 -41.08 98.64 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 121.125 0.488 . . . . 0.0 110.913 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.415 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -61.09 -38.12 85.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.646 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 107' ' ' ILE . 40.3 mm -61.29 -44.19 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.674 179.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 87.1 m-70 -64.7 -41.21 96.17 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.621 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -79.35 -23.04 43.65 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -179.47 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 104' ' ' ILE . 2.2 tp -63.87 -21.14 28.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.92 0.391 . . . . 0.0 111.425 -179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -75.48 -9.46 58.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.75 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 25.4 m120 -89.21 5.05 46.54 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.479 ' HE1' HD22 ' A' ' 25' ' ' LEU . 60.2 t80 -60.4 -49.17 78.63 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.63 0.252 . . . . 0.0 111.141 178.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 156.02 179.11 30.83 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.541 -0.837 . . . . 0.0 112.537 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -97.05 2.98 52.02 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.863 0.364 . . . . 0.0 111.336 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 25.1 m -126.16 157.48 36.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.192 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 88.2 mt -64.61 -40.11 94.91 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.026 -0.534 . . . . 0.0 112.26 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 69.7 m -132.67 148.21 68.64 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.794 -0.184 . . . . 0.0 111.107 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -78.05 68.22 7.88 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.742 2.295 . . . . 0.0 112.788 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 63.5 m -106.33 137.61 43.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.628 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 99.8 mt-10 -127.37 148.52 50.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.592 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -74.2 143.74 45.05 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.797 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.6 m -122.95 146.06 47.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.563 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -106.11 71.89 0.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.64 -179.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 58.9 -93.75 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.466 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 99.9 mt-10 -90.43 -9.85 45.98 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.706 0.288 . . . . 0.0 111.369 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.365 -1.242 . . . . 0.0 112.569 -179.87 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.598 0.237 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 57.75 53.37 7.16 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.035 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -63.97 -39.43 94.12 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.726 0.298 . . . . 0.0 111.28 179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.99 -55.64 3.68 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.497 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.2 m 59.92 41.44 17.73 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.848 0.459 . . . . 0.0 111.875 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 26.5 mmt -120.53 135.1 55.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.582 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.72 155.25 39.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.911 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -172.57 175.96 45.57 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.058 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 57.0 t30 55.15 44.23 28.16 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.103 0.478 . . . . 0.0 111.253 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 76.4 m -118.87 147.66 43.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.68 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 91.6 -8.29 78.86 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.938 -0.648 . . . . 0.0 112.753 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.64 45.83 0.97 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.726 0.298 . . . . 0.0 111.15 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.9 ttp-105 -61.7 -46.38 89.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.825 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 89.07 153.3 27.25 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 121.016 -0.612 . . . . 0.0 113.457 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.43 94.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.155 0.503 . . . . 0.0 110.857 178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 89.2 mt -96.89 149.33 21.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.624 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.533 ' CB ' ' HD2' ' A' ' 27' ' ' PRO . 0.8 OUTLIER -72.29 107.55 4.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.268 0.556 . . . . 0.0 111.605 -179.043 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -92.67 -8.56 43.67 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.125 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.51 ' HB2' ' HD3' ' A' ' 27' ' ' PRO . 79.7 m80 -103.33 21.05 16.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.69 -178.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.591 HG23 ' HD3' ' A' ' 26' ' ' PRO . 77.7 m -77.74 120.07 22.13 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.078 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.59 170.51 21.33 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.029 178.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.6 -50.4 69.56 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 113.144 0.794 . . . . 0.0 113.144 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -91.53 -35.0 14.54 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.363 0.602 . . . . 0.0 111.319 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -103.57 71.58 1.09 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.879 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 78.9 mt -44.7 156.95 0.33 Allowed Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.935 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.591 ' HD3' HG23 ' A' ' 20' ' ' THR . 4.1 Cg_exo -39.33 164.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.358 1.041 0 C-N-CA 124.999 3.799 . . . . 0.0 114.488 -178.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.533 ' HD2' ' CB ' ' A' ' 17' ' ' SER . 9.6 Cg_endo -54.65 -7.72 0.98 Allowed 'Trans proline' 0 C--N 1.358 1.029 0 C-N-CA 123.643 2.895 . . . . 0.0 113.973 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.685 ' HB1' ' HA ' ' A' ' 107' ' ' ILE . . . -55.43 -35.53 65.52 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.734 HD23 ' HD3' ' A' ' 84' ' ' LYS . 2.9 tp -105.7 -78.07 0.58 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.576 -0.45 . . . . 0.0 112.044 178.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.431 ' H ' ' HE3' ' A' ' 84' ' ' LYS . 61.7 tp -63.08 -46.04 89.31 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . 0.461 ' H ' ' HA ' ' A' ' 27' ' ' PRO . . . -60.01 -54.32 38.39 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.633 -0.794 . . . . 0.0 114.797 -177.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.429 ' HG3' ' HB2' ' A' ' 106' ' ' LEU . 14.7 tm-20 -73.2 -42.81 62.25 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.433 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 95.9 mt -67.6 -37.89 83.2 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.615 ' O ' ' HB2' ' A' ' 38' ' ' ASP . 13.7 p -78.98 -32.48 45.27 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.883 -179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.31 -55.62 3.93 Favored 'General case' 0 N--CA 1.463 0.221 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -64.93 -44.58 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -178.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 80.9 mt -72.62 -19.27 61.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.249 -179.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.615 ' HB2' ' O ' ' A' ' 34' ' ' CYS . 34.2 t0 -60.49 -36.81 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.88 0.371 . . . . 0.0 110.829 179.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 63.1 m -86.01 5.14 34.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.108 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 45' ' ' GLY . 52.0 t -65.33 141.94 58.41 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.291 0.567 . . . . 0.0 111.629 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -130.0 43.72 3.08 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.891 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 94.06 -12.5 69.07 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.402 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.3 97.16 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.037 0.418 . . . . 0.0 111.4 179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.75 -23.38 10.65 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.649 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.41 ' N ' ' SG ' ' A' ' 40' ' ' CYS . . . 78.41 109.9 0.19 Allowed Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.738 -178.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.8 p90 -52.73 -48.61 66.58 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 117.315 0.558 . . . . 0.0 110.674 178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 46.5 ptt85 -83.74 1.28 43.49 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.576 177.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.67 -43.18 94.5 Favored Glycine 0 C--N 1.329 0.189 0 C-N-CA 120.707 -0.759 . . . . 0.0 113.086 -178.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 91.2 mt -80.41 -41.58 24.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 117.029 0.415 . . . . 0.0 111.088 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.536 ' HA ' HD22 ' A' ' 77' ' ' LEU . . . -63.64 -41.68 98.21 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -60.18 -46.2 90.52 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.303 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -67.51 -39.19 85.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.943 179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.72 HD22 HD21 ' A' ' 77' ' ' LEU . 4.0 tt -65.76 -43.52 88.65 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.853 -178.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 40.0 t -153.96 142.56 20.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 0.0 111.2 -179.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.0 m -121.09 137.54 54.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.329 179.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.9 t -156.52 154.34 30.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.049 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 32.0 m-90 -71.54 136.79 47.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.629 0.252 . . . . 0.0 110.657 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 86.2 mt 64.12 14.91 8.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.066 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -65.08 -39.63 93.48 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.221 0.534 . . . . 0.0 111.061 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.794 ' HA ' HD12 ' A' ' 63' ' ' ILE . 35.5 m -68.11 -17.51 22.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.493 -179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -61.04 -47.84 84.52 Favored 'General case' 0 CA--C 1.523 -0.06 0 CA-C-O 120.608 0.242 . . . . 0.0 110.879 -178.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.578 ' CD2' ' HG2' ' A' ' 76' ' ' GLU . 8.3 p-80 -78.5 -20.08 51.59 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.642 -0.423 . . . . 0.0 111.446 179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.794 HD12 ' HA ' ' A' ' 60' ' ' VAL . 79.6 mt -62.23 -42.22 94.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.184 0 CA-C-O 121.461 0.648 . . . . 0.0 110.068 178.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.568 ' O ' HG12 ' A' ' 67' ' ' VAL . 80.0 mm-40 -69.54 -33.4 72.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.756 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 62' ' ' HIS . 98.3 mttt -62.86 -48.3 79.64 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.634 1.346 . . . . 0.0 114.634 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.584 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 57.3 mm-40 -89.81 -4.33 57.68 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.668 -0.645 . . . . 0.0 112.739 -178.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.568 HG12 ' O ' ' A' ' 64' ' ' GLU . 4.3 p -57.38 -33.3 43.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 118.161 0.437 . . . . 0.0 111.173 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -89.27 -4.63 58.08 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.939 0.4 . . . . 0.0 110.571 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -107.13 22.45 15.97 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.059 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.625 ' O ' ' HB3' ' A' ' 71' ' ' LYS . . . 104.65 13.4 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 120.257 -0.973 . . . . 0.0 114.595 179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.625 ' HB3' ' O ' ' A' ' 70' ' ' GLY . 0.8 OUTLIER 102.21 144.67 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 124.858 1.263 . . . . 0.0 111.916 177.295 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.622 ' O ' ' HB3' ' A' ' 76' ' ' GLU . 2.9 t -130.7 -31.61 1.75 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.195 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.502 ' O ' ' HB2' ' A' ' 50' ' ' ALA . . . -54.21 -63.35 5.25 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 119.841 -1.171 . . . . 0.0 111.546 179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.449 ' H ' ' HD2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -89.08 -39.91 13.31 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.435 0.531 . . . . 0.0 112.435 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.521 ' H ' ' HG3' ' A' ' 71' ' ' LYS . 59.1 ttt85 -62.37 -48.7 78.59 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 72' ' ' SER . 53.1 tp10 -63.43 -39.71 95.22 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.763 0.316 . . . . 0.0 110.772 -179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.72 HD21 HD22 ' A' ' 53' ' ' LEU . 64.5 tp -61.05 -45.98 92.55 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.28 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.48 ' HB3' ' HA ' ' A' ' 84' ' ' LYS . 83.9 mt -69.51 -39.32 77.64 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.945 0.402 . . . . 0.0 110.979 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 70.4 m95 -77.01 -5.78 50.06 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.8 m -58.53 -40.15 82.15 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . . . . . . . . . 74.6 m95 -86.42 -89.66 0.11 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.735 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -107.7 -86.7 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -114.37 -55.01 2.54 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.734 ' HD3' HD23 ' A' ' 29' ' ' LEU . 1.2 ttmp? -132.05 -44.66 0.95 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 175.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.5 t30 46.03 36.88 3.3 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.197 -0.911 . . . . 0.0 111.918 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -138.86 161.91 36.1 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 72.0 p -115.33 155.2 27.77 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.509 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 1.4 mp -60.56 -38.52 78.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.12 -179.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.517 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -61.47 -39.83 97.84 Favored Glycine 0 CA--C 1.52 0.348 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.581 179.365 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.32 -45.3 91.95 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.636 0.255 . . . . 0.0 111.644 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -72.51 -26.0 61.61 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.832 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.746 HD21 HG12 ' A' ' 107' ' ' ILE . 53.6 mt -59.54 -38.22 80.5 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -61.79 -42.17 98.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.037 0.446 . . . . 0.0 109.998 179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 91.1 t -70.72 -41.22 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.352 178.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 91' ' ' LEU . 4.5 mp -59.01 -38.7 79.84 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.612 -179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -62.51 -40.24 96.1 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.867 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -65.53 -41.99 92.47 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 9.4 tpt -70.99 -38.73 72.71 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.419 179.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 82.0 30.19 35.7 Favored Glycine 0 C--N 1.333 0.408 0 C-N-CA 120.73 -0.747 . . . . 0.0 113.177 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -79.36 107.43 12.11 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.044 0.449 . . . . 0.0 110.649 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.95 -41.45 95.48 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -61.33 -40.52 94.53 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.234 -178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.435 ' O ' ' HB ' ' A' ' 107' ' ' ILE . . . -60.99 -39.74 90.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.5 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.594 ' O ' HG22 ' A' ' 107' ' ' ILE . 97.3 mt -63.12 -43.89 99.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.014 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 82.7 m-70 -64.48 -41.42 96.5 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.523 HD13 ' HA ' ' A' ' 106' ' ' LEU . 0.5 OUTLIER -80.87 -22.04 40.18 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -179.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.746 HG12 HD21 ' A' ' 92' ' ' LEU . 1.8 tp -62.04 -20.36 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 70.3 p -72.07 -11.26 60.67 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.639 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -83.49 15.98 2.82 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.887 0.375 . . . . 0.0 111.471 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' TYR . . . . . 0.508 ' CD1' HD13 ' A' ' 88' ' ' ILE . 63.4 t80 -94.92 124.72 39.13 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.993 0.425 . . . . 0.0 110.814 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -142.39 72.59 0.38 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.403 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -147.6 155.93 42.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.683 0.277 . . . . 0.0 110.98 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 14.6 p -135.68 145.12 31.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.455 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.6 mt 62.75 38.9 11.47 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.57 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 78.1 p -77.25 155.84 81.88 Favored Pre-proline 0 CA--C 1.533 0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.208 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -60.0 144.58 99.46 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.021 2.48 . . . . 0.0 112.814 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 61.9 m -119.6 149.62 41.65 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.54 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 25.8 pm0 -67.2 151.57 47.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.341 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 63.3 mtpt -82.05 -11.97 58.51 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.395 -179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 51.0 m 57.48 41.18 26.44 Favored 'General case' 0 N--CA 1.468 0.45 0 O-C-N 123.585 0.553 . . . . 0.0 111.372 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -111.67 126.25 54.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.256 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLN . . . . . . . . . . . . . 99.6 mm-40 65.95 -99.75 0.06 Allowed 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.631 0.582 . . . . 0.0 111.422 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -119.12 139.7 51.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 110.689 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.45 -179.923 . . . . . . . . 0 0 . 1 stop_ save_